SCHEMBL3924487

SCHEMBL3924487

CN(C)N1CCCC1C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ACE P12821 9/20 0.41
REN P00797 3/20 0.41
LMNA P02545 2/20 0.41
HSD17B10 Q99714 2/20 0.41
MAPT P10636 2/20 0.41
CYP2C19 P33261 1/20 0.41
KDM4E B2RXH2 1/20 0.41
F2 P00734 1/20 0.41
LTA4H P09960 1/20 0.41
PEPD P12955 1/20 0.41
ALOX15 P16050 1/20 0.41
PTGS1 P23219 1/20 0.41
HTR2A P28223 1/20 0.41
PTGS2 P35354 1/20 0.41
HRH1 P35367 1/20 0.41
THPO P40225 1/20 0.41
PMP22 Q01453 1/20 0.41
ACE2 Q9BYF1 1/20 0.41
RAB9A P51151 1/20 0.40

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
SCHEMBL28261258 1.00 ACE (0.41) ACERENLMNAHSD17B10MAPT
SCHEMBL24162042 0.83 DPP4 (0.36) ACERENLMNAHSD17B10MAPT
SCHEMBL5695504 0.82 PIK3CA (0.34) LMNAKDM4E
SCHEMBL9456502 0.82 PIK3CA (0.34) LMNAKDM4E
SCHEMBL28267035 0.80 ACE (0.43) ACERENLMNAHSD17B10MAPT
SCHEMBL10906984 0.79 ACE (0.41) ACERENLMNAHSD17B10MAPT
SCHEMBL23077176 0.79 BCHE (0.35) KDM4E
SCHEMBL6535156 0.76 LMNA (0.43) ACERENLMNAHSD17B10MAPT
SCHEMBL9230240 0.76 ACE (0.40) ACERENLMNAHSD17B10MAPT
SCHEMBL9853736 0.74

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108852993-A Moisturizing beautifying liquid 常州市长昊机械有限公司 2018-11-23 CN disclosed
CN-108852993-A Moisturizing beautifying liquid 常州市长昊机械有限公司 2018-11-23 CN disclosed
US-20170355701-A1 HEPATITIS B ANTIVIRAL AGENTS ENANTA PHARMACEUTICALS, INC. 2017-12-14 US disclosed
EP-2041138-A2 PYRROLOTRIAZINE KINASE INHIBITORS Brystol-Myers Squibb Company (US) 2009-04-01 EP disclosed
WO-2008005956-A2 PYRROLOTRIAZINE KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2008-01-10 WO 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 (1 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-20170355701-A1 HEPATITIS B ANTIVIRAL AGENTS HAVCR2, SLC10A1, HDGF ACE 415/4885REN 2855/4885LMNA 2852/4885

“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.