SCHEMBL6609482

SCHEMBL6609482

COc1ccc(/C(C#N)=C/c2ccncc2)nc1OC1Cc2ccccc2C1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.41
KMT2A Q03164 5/20 0.41
MEN1 O00255 4/20 0.41
ATM Q13315 1/20 0.41
EGFR P00533 2/20 0.41
IGF1R P08069 1/20 0.41
IGF2R P11717 1/20 0.41
KDM4E B2RXH2 9/20 0.40
LMNA P02545 3/20 0.39
HPGD P15428 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
RECQL P46063 2/20 0.39
HIF1A Q16665 1/20 0.39
PDGFRB P09619 1/20 0.39
PDGFRA P16234 1/20 0.39
NPC1 O15118 4/20 0.38
RAB9A P51151 4/20 0.38
ALDH1A1 P00352 3/20 0.38
GAA P10253 1/20 0.38
POLB P06746 3/20 0.37

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
SCHEMBL6609487 1.00 MAPT (0.41) MAPTKMT2AMEN1ATMEGFR
SCHEMBL6606341 0.87 MAPT (0.37) MAPTKMT2AMEN1ATMEGFR
SCHEMBL6606089 0.87 MAPT (0.39) MAPTKMT2AMEN1ATMEGFR
SCHEMBL6606084 0.87 MAPT (0.39) MAPTKMT2AMEN1ATMEGFR
SCHEMBL6611313 0.86 EGFR (0.45) MAPTKMT2AMEN1ATMEGFR
SCHEMBL6611309 0.86 EGFR (0.45) MAPTKMT2AMEN1ATMEGFR
SCHEMBL6610871 0.85 MAPT (0.44) MAPTKMT2AMEN1ATMEGFR
SCHEMBL6610876 0.85 MAPT (0.44) MAPTKMT2AMEN1ATMEGFR
SCHEMBL6606526 0.83 PDE4B (0.42) MAPTKMT2AMEN1ATMEGFR
SCHEMBL6606520 0.83 PDE4B (0.42) MAPTKMT2AMEN1ATMEGFR

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-0882714-B1 SUBSTITUTED VINYLPYRIDINE DERIVATIVES AND DRUGS CONTAINING THE SAME SS PHARMACEUTICAL CO (JP) 2004-03-03 EP disclosed
US-5935977-A PHOSPHODIESTERASE IV INHIBITORS, TUMOR NECROSIS FACTOR-ALPHA PRODUCTION INHIBITORS; TREATING INFLAMMATORY AND AUTOIMMUNE DISEASES SS PHARMACEUTICAL CO., LTD. (JP) 1999-08-10 US disclosed
EP-0882714-A1 SUBSTITUTED VINYLPYRIDINE DERIVATIVES AND DRUGS CONTAINING THE SAME SS Pharmaceutical Co., Ltd. (JP) 1998-12-09 EP disclosed