SCHEMBL10779883

SCHEMBL10779883

CC=Cc1nc(-c2ccccc2)c[nH]1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.40
MEN1 O00255 5/20 0.38
KMT2A Q03164 5/20 0.38
RAB9A P51151 2/20 0.38
PDGFRB P09619 1/20 0.38
L3MBTL1 Q9Y468 5/20 0.37
ALDH1A1 P00352 2/20 0.37
HPGD P15428 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MAPT P10636 3/20 0.36
KDM4E B2RXH2 3/20 0.36
TDP1 Q9NUW8 2/20 0.35
TSHR P16473 1/20 0.34
ATM Q13315 1/20 0.34
ADORA2A P29274 2/20 0.33
ADORA1 P30542 2/20 0.33
AKT1 P31749 1/20 0.33
AKT2 P31751 1/20 0.33
HTR3A P46098 1/20 0.33
NPC1 O15118 1/20 0.33

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
SCHEMBL12068346 0.82 MAPK1 (0.58) MAPK1MEN1KMT2ARAB9AL3MBTL1
SCHEMBL12068348 0.82 MAPK1 (0.58) MAPK1MEN1KMT2ARAB9AL3MBTL1
SCHEMBL21673240 0.79 MEN1 (0.36) MAPK1MEN1KMT2ARAB9APDGFRB
SCHEMBL1562816 0.78 MEN1 (0.40) MAPK1MEN1KMT2ARAB9APDGFRB
SCHEMBL258654 0.78 MAPK1 (0.41) MAPK1MEN1KMT2ARAB9APDGFRB
SCHEMBL19669701 0.77 NPC1 (0.50) MAPK1MEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL12067548 0.77 NPC1 (0.50) MAPK1MEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL1676998 0.76 NPC1 (0.48) MAPK1MEN1KMT2ARAB9AL3MBTL1
SCHEMBL1676996 0.76 NPC1 (0.48) MAPK1MEN1KMT2ARAB9AL3MBTL1
SCHEMBL11040100 0.76 NPC1 (0.43) MAPK1MEN1KMT2ARAB9APDGFRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0146498-B1 HARDENABLE COMPOSITION CONTAINING AN EPOXY RESIN, AN IMIDE AND A HARDENING CATALYST CIBA-GEIGY AG (CH) 1987-04-08 EP disclosed
US-4579916-A IMPROVED STORAGE STABILITY CIBA-GEIGY CORPORATION (US) 1986-04-01 US disclosed
EP-0146498-A2 Hardenable composition containing an epoxy resin, an imide and a hardening catalyst CIBA-GEIGY AG (CH) 1985-06-26 EP disclosed