SCHEMBL31511503

SCHEMBL31511503

COc1ccc(N)nc1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MCHR1 Q99705 1/20 0.48
▸ ALDH1A1 P00352 3/20 0.41
▸ KDM4E B2RXH2 3/20 0.40
▸ NCF1 P14598 1/20 0.40
▸ MAPK1 P28482 3/20 0.39
▸ AGPAT2 O15120 4/20 0.39
▸ NOS1 P29475 1/20 0.39
▸ HSP90AA1 P07900 2/20 0.39
▸ DYRK1A Q13627 1/20 0.39
▸ HSP90AB1 P08238 1/20 0.39
▸ MAPT P10636 4/20 0.38
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ NPC1 O15118 2/20 0.38

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
SCHEMBL2252229 1.00 MCHR1 (0.48) MCHR1ALDH1A1KDM4ENCF1MAPK1
SCHEMBL5431429 0.82 ALDH1A1 (0.44) ALDH1A1KDM4EMAPK1HSP90AA1HSP90AB1
SCHEMBL9810196 0.77 MCHR1 (0.52) MCHR1ALDH1A1KDM4ENCF1MAPK1
SCHEMBL28064741 0.76 HSP90AA1 (0.51) MCHR1ALDH1A1KDM4EHSP90AA1HSP90AB1
SCHEMBL7226169 0.76 ALDH1A1 (0.42) ALDH1A1KDM4EMAPK1HSP90AA1HSP90AB1
SCHEMBL3771034 0.76 NOS3 (0.54) MCHR1ALDH1A1KDM4ENCF1MAPK1
SCHEMBL359862 0.76 MCHR1 (0.50) MCHR1ALDH1A1KDM4ENCF1MAPK1
SCHEMBL7970266 0.76 MCHR1 (0.50) MCHR1ALDH1A1KDM4ENCF1MAPK1
SCHEMBL7849602 0.74 TLR8 (0.44) MCHR1ALDH1A1KDM4EMAPK1HSP90AA1
SCHEMBL5696517 0.74 ALDH1A1 (0.41) ALDH1A1KDM4EMAPK1HSP90AA1MAPT

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
WO-2025081019-A1 KIF MODULATOR COMPOUNDS AND METHODS OF USE IAMBIC THERAPEUTICS, INC. (US) 2025-04-17 — — WO disclosed
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