SCHEMBL24687064

SCHEMBL24687064

Cc1cc(NC(=O)Cc2ccc(F)cc2Cl)ccc1COc1ccc(C#N)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MMP1 P03956 4/20 0.46
▸ P2RX4 Q99571 1/20 0.46
▸ MEN1 O00255 3/20 0.44
▸ KMT2A Q03164 3/20 0.44
▸ POLB P06746 2/20 0.44
▸ P2RX7 Q99572 1/20 0.44
▸ ADAMTS4 O75173 1/20 0.44
▸ MMP2 P08253 1/20 0.44
▸ MMP13 P45452 1/20 0.44
▸ MMP14 P50281 1/20 0.44
▸ ADAMTS5 Q9UNA0 1/20 0.44
▸ HTT P42858 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ ROCK2 O75116 1/20 0.43
▸ RECQL P46063 1/20 0.42
▸ USP2 O75604 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ NPC1 O15118 1/20 0.41

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
SCHEMBL29852222 0.85 P2RX4 (0.57) P2RX4ADAMTS4MMP2MMP13MMP14
SCHEMBL24686709 0.85 P2RX4 (0.57) P2RX4ADAMTS4MMP2MMP13MMP14
SCHEMBL24687065 0.85 ANO1 (0.47) P2RX4MEN1KMT2ANPSR1USP2
SCHEMBL24687063 0.85 ROCK2 (0.47) MMP1P2RX4MEN1KMT2APOLB
SCHEMBL24685938 0.82 LMNA (0.42) P2RX4ADAMTS4MMP2MMP13MMP14
SCHEMBL24687062 0.81 NPC1 (0.40) MEN1KMT2APOLBHTTNPSR1
SCHEMBL24686371 0.80 RECQL (0.56) P2RX4MEN1KMT2APOLBP2RX7
SCHEMBL24687090 0.80 ADAMTS4 (0.51) MMP1P2RX4MEN1KMT2APOLB
SCHEMBL24685990 0.80 P2RX4 (0.44) P2RX4MEN1KMT2AADAMTS4MMP2
SCHEMBL29852103 0.79 P2RX4 (0.57) P2RX4

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-2022161416-A1 AROMATIC COMPOUND, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 武汉朗来科技发展有限公司 2022-08-04 — — WO disclosed
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