SCHEMBL4572901

SCHEMBL4572901

NCCNc1cccnc1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.50
CHRNA7 P36544 1/20 0.47
LTA4H P09960 1/20 0.46
CYP2A6 P11509 1/20 0.44
CDK2 P24941 1/20 0.44
FLT4 P35916 1/20 0.44
KDM4C Q9H3R0 1/20 0.44
LMNA P02545 1/20 0.44
GAA P10253 1/20 0.43
SPR P35270 1/20 0.43
MEN1 O00255 1/20 0.42
MAPT P10636 1/20 0.42
PABPC1 P11940 1/20 0.42
KMT2A Q03164 1/20 0.42
HRH1 P35367 2/20 0.42
NPC1 O15118 1/20 0.42
PKM P14618 1/20 0.42
CFTR P13569 1/20 0.42
GOPC Q9HD26 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL21087536 0.89 CYP2A6 (0.50) RAB9ACHRNA7LTA4HCYP2A6CDK2
SCHEMBL9546458 0.83 RAB9A (0.43) RAB9ACHRNA7LTA4HCYP2A6CDK2
Hydrochloric Acid SCHEMBL6036964 0.81 RAB9A (0.42) RAB9ACHRNA7LTA4HCYP2A6CDK2
SCHEMBL3643530 0.80 RAB9A (0.54) RAB9ALTA4HCDK2FLT4KDM4C
SCHEMBL27316413 0.80 RAB9A (0.50) RAB9ALTA4HCDK2FLT4GAA
SCHEMBL15055378 0.80 RAB9A (0.50) RAB9ALTA4HCDK2FLT4LMNA
SCHEMBL4383419 0.80 RAB9A (0.50) RAB9ALTA4HCDK2FLT4LMNA
SCHEMBL22851453 0.78 RAB9A (0.53) RAB9ACHRNA7LTA4HCYP2A6CDK2
SCHEMBL9036375 0.77 RAB9A (0.47) RAB9ALTA4HCDK2FLT4GAA
SCHEMBL7999576 0.77 HDAC3 (0.53) RAB9ALTA4HCDK2FLT4GAA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080207683-A1 BIARYL-SUBSTITUTED TETRAHYDRO-PYRAZOLO-PYRIDINE MODULATORS OF CATHEPSIN S SUNESIS PHARMACEUTICALS, INC. 2008-08-28 US claimed
WO-2008100622-A2 BIARYL-SUBSTITUTED TETRAHYDRO-PYRAZOLO-PYRIDINE MODULATORS OF CATHEPSIN S SUNESIS PHARMACEUTICALS, INC. (US) 2008-08-21 WO claimed
CN-119841829-A Compounds for the treatment of PI3K gamma mediated diseases and uses thereof 中国科学院合肥物质科学研究院 2025-04-18 CN disclosed
US-10913735-B2 Bis-heteroaryl derivatives as modulators of protein aggregation UCB Biopharma SRL (BE) 2021-02-09 US disclosed
EP-2925744-B1 PYRIMIDINE-2,4-DIAMINE DERIVATIVES FOR TREATMENT OF CANCER THOMAS HELLEDAYS STIFTELSE FOER MEDICINSK FORSKNING (SE) 2020-12-30 EP disclosed
US-10632125-B2 MTH1 inhibitors for treatment of inflammatory and autoimmune conditions THOMAS HELLEDAYS STIFTELSE FOR MEDICINSK FORSKNING (SE) 2020-04-28 US disclosed
US-10174029-B2 Pyrimidine-2,4-diamine derivatives for treatment of cancer THOMAS HELLEDAYS STIFTELSE FOR MEDICINSK FORSKNING (SE) 2019-01-08 US disclosed
US-20190000856-A1 MTH1 INHIBITORS FOR TREATMENT OF INFLAMMATORY AND AUTOIMMUNE CONDITIONS THOMAS HELLEDAYS STIFTELSE FOER MEDICINSK FORSKNING (SE) 2019-01-03 US disclosed
US-10064869-B2 MTH1 inhibitors for treatment of inflammatory and autoimmune conditions THOMAS HELLEDAYS STIFTELSE FOR MEDICINSK FORSKNING (SE) 2018-09-04 US disclosed
US-20180170929-A1 PYRIMIDINE-2,4-DIAMINE DERIVATIVES FOR TREATMENT OF CANCER THOMAS HELLEDAYS STIFTELSE FOR MEDICINSK FORSKNING (SE) 2018-06-21 US disclosed
US-9944640-B2 Pyrimidine-2,4-diamine derivatives for treatment of cancer THOMAS HELLEDAYS STIFTELSE FOR MEDICINSK FORSKNING (SE) 2018-04-17 US disclosed
EP-0796847-B1 Pyridine derivative, anti-ulcer drug, and antibacterial drug SHISEIDO CO LTD (JP) 2001-11-28 EP disclosed
US-6017937-A BACTERICIDE AGAINST HELICOBACTER PYROLI; INHIBITING ACID SECRETION IN STOMACH OF MAN OR MAMMALS, PREVENTING OR CURING ULCER SHISEIDO CO., LTD. (JP) 2000-01-25 US disclosed
US-5859032-A HAVING ANTIBACTERIAL ACTIVITY AGAINST HELICOBACTER PYLORI SHISEIDO CO., LTD. (JP) 1999-01-12 US disclosed
EP-0796847-A1 Pyridine derivative, anti-ulcer drug, and antibacterial drug SHISEIDO COMPANY LIMITED (JP) 1997-09-24 EP disclosed
EP-0268229-B1 IMIDAZOLIDINONE COMPOUNDS, PROCESSES FOR PREPARATION THEREOF, COMPOSITIONS COMPRISING SUCH COMPOUNDS, AND THE USE OF SUCH COMPOUNDS FOR THE MANUFACTURE OF MEDICAMENTS HAVING THERAPEUTIC VALUE TANABE SEIYAKU CO., LTD. (JP) 1992-07-08 EP disclosed
CN-1017245-B Process for preparing imidazolidinone compound TANABE SEIYAKU CO (JP) 1992-07-01 CN disclosed
US-4886817-A Imidazolidinones as brain activators TANABE SEIYAKU CO., LTD. (JP) 1989-12-12 US disclosed
CN-87107864-A Imidazolidinone compound and preparation method thereof 1988-08-31 CN disclosed
EP-0268229-A2 Imidazolidinone compounds, processes for preparation thereof, compositions comprising such compounds, and the use of such compounds for the manufacture of medicaments having therapeutic value TANABE SEIYAKU CO., LTD. (JP) 1988-05-25 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20180170929-A1 PYRIMIDINE-2,4-DIAMINE DERIVATIVES FOR TREATMENT OF CANCER DPYD, MTHFD1, TYMS RAB9A 3247/4885CHRNA7 4840/4885LTA4H 3349/4885
US-10174029-B2 Pyrimidine-2,4-diamine derivatives for treatment of cancer DPYD, MTHFD1, TYMS RAB9A 3247/4885CHRNA7 4840/4885LTA4H 3349/4885
US-20190000856-A1 MTH1 INHIBITORS FOR TREATMENT OF INFLAMMATORY AND AUTOIMMUNE CONDITIONS MTHFD1, MTHFD2, TPMT RAB9A 2672/4885CHRNA7 4674/4885LTA4H 1340/4885
US-10632125-B2 MTH1 inhibitors for treatment of inflammatory and autoimmune conditions MTHFD1, MTHFD2, TPMT RAB9A 2672/4885CHRNA7 4674/4885LTA4H 1340/4885
US-20080207683-A1 BIARYL-SUBSTITUTED TETRAHYDRO-PYRAZOLO-PYRIDINE MODULATORS OF CATHEPSIN S CTSS, CTSK, CTSZ RAB9A 502/4885CHRNA7 4456/4885LTA4H 919/4885
US-10913735-B2 Bis-heteroaryl derivatives as modulators of protein aggregation PARK7, HTT, SNCA RAB9A 417/4885CHRNA7 1377/4885LTA4H 3740/4885
US-10064869-B2 MTH1 inhibitors for treatment of inflammatory and autoimmune conditions MTHFD1, MTHFD2, TPMT RAB9A 2672/4885CHRNA7 4674/4885LTA4H 1340/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.