SCHEMBL3948701

SCHEMBL3948701

c1ccc(Nc2ccncn2)nc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.57
MEN1 O00255 1/20 0.57
MAPK10 P53779 1/20 0.57
GFER P55789 1/20 0.57
KDR P35968 5/20 0.49
NPC1 O15118 4/20 0.46
RAB9A P51151 4/20 0.46
LMNA P02545 4/20 0.46
TP53 P04637 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
MAPT P10636 2/20 0.46
NFKB1 P19838 1/20 0.46
MAPK1 P28482 1/20 0.46
NFKB2 Q00653 1/20 0.46
RELA Q04206 1/20 0.46
GSK3A P49840 1/20 0.45
CDK9 P50750 1/20 0.45
CDK5 Q00535 1/20 0.45
TAOK1 Q7L7X3 1/20 0.45
CLK4 Q9HAZ1 1/20 0.45

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
SCHEMBL31355480 1.00 KMT2A (0.57) KMT2AMEN1MAPK10GFERKDR
SCHEMBL31355479 1.00 KMT2A (0.57) KMT2AMEN1MAPK10GFERKDR
SCHEMBL3628141 0.89 MEN1 (0.47) KMT2AMEN1MAPK10GFERKDR
SCHEMBL4630887 0.87 GSK3A (0.53) KDRSMN1; SMN2GSK3ACDK9CDK5
Hydrochloric Acid SCHEMBL7857018 0.84 GSK3A (0.51) KDRSMN1; SMN2GSK3ACDK9CDK5
SCHEMBL221242 0.84 KMT2A (0.76) KMT2AMEN1MAPK10GFERKDR
SCHEMBL29391624 0.84 KMT2A (0.76) KMT2AMEN1MAPK10GFERKDR
SCHEMBL6574416 0.82 KMT2A (0.73) KMT2AMEN1MAPK10GFERKDR
SCHEMBL11133606 0.82 KMT2A (0.73) KMT2AMEN1MAPK10GFERKDR
SCHEMBL4243882 0.82 KMT2A (0.73) KMT2AMEN1MAPK10GFERKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4719421-A1 COMBINATION THERAPY COMPRISING KIT INHIBITORS FOR USE IN THE TREATMENT OF CANCER IDRX, INC. (US) 2026-04-08 EP disclosed
US-20250270190-A1 KIT INHIBITORS BLUEPRINT MEDICINES CORPORATION 2025-08-28 US disclosed
EP-4511366-A1 KIT INHIBITORS Blueprint Medicines Corporation (US) 2025-02-26 EP disclosed
WO-2024249855-A1 COMBINATION THERAPY COMPRISING KIT INHIBITORS FOR USE IN THE TREATMENT OF CANCER IDRX, INC. (US) 2024-12-05 WO disclosed
WO-2023205226-A1 KIT INHIBITORS BLUEPRINT MEDICINES CORPORATION (US) 2023-10-26 WO disclosed
US-11691986-B2 PTEFB inhibiting macrocyclic compounds BAYER AKTIENGESELLSCHAFT (DE) 2023-07-04 US disclosed
US-20220281892-A1 NOVEL PTEFB INHIBITING MACROCYCLIC COMPOUNDS BAYER AKTIENGESELLSCHAFT (DE) 2022-09-08 US disclosed
US-20220059772-A1 COMPOUNDS, INFRARED ABSORBERS, INFRARED ABSORBING/BLOCKING FILMS, PHOTOELECTRIC DEVICES, SENSORS, AND ELECTRONIC DEVICES SAMSUNG ELECTRONICS CO., LTD. (KR) 2022-02-24 US disclosed
US-11254690-B2 PTEFb inhibiting macrocyclic compounds BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2022-02-22 US disclosed
US-11242356-B2 PTEFb inhibiting macrocyclic compounds BAYER AKTIENGESELLSCHAFT (DE) 2022-02-08 US disclosed
CN-104918932-A N-(pyridin-2-yl)pyrimidin-4-amine derivatives containing a sulfoximine group Bayer Pharma AG 2015-09-16 CN disclosed
EP-2909200-A2 N-(PYRIDIN-2-YL)PYRIMIDIN-4-AMINE DERIVATIVES CONTAINING A SULFONE GROUP Bayer Pharma Aktiengesellschaft (DE) 2015-08-26 EP disclosed
EP-2909200-A2 N-(PYRIDIN-2-YL)PYRIMIDIN-4-AMINE DERIVATIVES CONTAINING A SULFONE GROUP Bayer Pharma Aktiengesellschaft (DE) 2015-08-26 EP disclosed
WO-2015001021-A1 SULFOXIMINE SUBSTITUTED 5-FLUORO-N-(PYRIDIN-2-YL)PYRIDIN-2-AMINE DERIVATIVES AND THEIR USE AS CDK9 KINASE INHIBITORS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2015-01-08 WO disclosed
WO-2014060493-A3 N-(PYRIDIN-2-YL)PYRIMIDIN-4-AMINE DERIVATIVES CONTAINING A SULFONE GROUP BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2014-08-07 WO disclosed
WO-2014076111-A1 N-(PYRIDIN-2-YL)PYRIMIDIN-4-AMINE DERIVATIVES CONTAINING A SULFOXIMINE GROUP BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2014-05-22 WO disclosed
WO-2014076111-A1 N-(PYRIDIN-2-YL)PYRIMIDIN-4-AMINE DERIVATIVES CONTAINING A SULFOXIMINE GROUP BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2014-05-22 WO disclosed
WO-2014060493-A2 N-(PYRIDIN-2-YL)PYRIMIDIN-4-AMINE DERIVATIVES CONTAINING A SULFONE GROUP BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2014-04-24 WO disclosed
WO-2014060493-A2 N-(PYRIDIN-2-YL)PYRIMIDIN-4-AMINE DERIVATIVES CONTAINING A SULFONE GROUP BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2014-04-24 WO disclosed
WO-2009029617-A1 DIARYLAMINE-SUBSTITUTED QUINOLONES USEFUL AS INDUCIBLE NITRIC OXIDE SYNTHASE INHIBITORS KALYPSYS, INC. (US) 2009-03-05 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 (6 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-11242356-B2 PTEFb inhibiting macrocyclic compounds PCLAF, PPIB, RHEB KMT2A 3422/4885MEN1 647/4885MAPK10 896/4885
US-20220281892-A1 NOVEL PTEFB INHIBITING MACROCYCLIC COMPOUNDS PCLAF, PKD1, RHEB KMT2A 3620/4885MEN1 803/4885MAPK10 751/4885
US-20250270190-A1 KIT INHIBITORS KIT, ABL1, APC KMT2A 232/4885MEN1 854/4885MAPK10 114/4885
US-20220059772-A1 COMPOUNDS, INFRARED ABSORBERS, INFRARED ABSORBING/BLOCKING FILMS, PHOTOELECTRIC DEVICES, SENSORS, AND ELECTRONIC DEVICES CRY1, SCN1B, CCNT1 KMT2A 3047/4885MEN1 218/4885MAPK10 2359/4885
US-11254690-B2 PTEFb inhibiting macrocyclic compounds PCLAF, PPIB, RHEB KMT2A 3422/4885MEN1 647/4885MAPK10 896/4885
US-11691986-B2 PTEFB inhibiting macrocyclic compounds PCLAF, PPIB, RHEB KMT2A 3422/4885MEN1 647/4885MAPK10 896/4885

“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.