SCHEMBL21254620

SCHEMBL21254620

CN/C=C(\C(C)=N)C(=O)Nc1ccc(Nc2ccc(NC(=O)c3ccc(N4CCC(O)CC4)cc3)cc2)c(Cl)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 8/20 0.39
▸ ATM Q13315 1/20 0.39
▸ KMT2A Q03164 6/20 0.38
▸ NPC1 O15118 5/20 0.38
▸ RAB9A P51151 5/20 0.38
▸ SMN1; SMN2 Q16637 4/20 0.38
▸ LMNA P02545 4/20 0.38
▸ MEN1 O00255 4/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ HPGD P15428 2/20 0.38
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ MCL1 Q07820 1/20 0.38
▸ MCHR1 Q99705 1/20 0.38
▸ ALDH1A1 P00352 3/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ WDR91 A4D1P6 1/20 0.37
▸ USP2 O75604 2/20 0.37
▸ TNIK Q9UKE5 1/20 0.37
▸ CSF1R P07333 1/20 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
SCHEMBL21254918 0.90 MAPT (0.40) MAPTATMKMT2ANPC1RAB9A
SCHEMBL21254462 0.90 MAPT (0.45) MAPTATMKMT2ANPC1RAB9A
SCHEMBL21254471 0.88 MAPT (0.38) MAPTATMKMT2ANPC1RAB9A
SCHEMBL1667332 0.85 MAPT (0.48) MAPTATMKMT2ANPC1RAB9A
SCHEMBL21254482 0.84 MAPT (0.39) MAPTATMKMT2ANPC1RAB9A
SCHEMBL21254900 0.83 MAPT (0.45) MAPTATMKMT2ANPC1RAB9A
SCHEMBL21254752 0.82 WDR91 (0.43) MAPTATMKMT2ANPC1RAB9A
SCHEMBL1665404 0.80 EGFR (0.44) MAPTKMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL1665398 0.80 EGFR (0.44) MAPTKMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL21254622 0.80 WDR91 (0.43) MAPTKMT2ANPC1RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2488486-B1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES LIGAND PHARM INC (US) 2019-08-14 — — EP disclosed
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