SCHEMBL29005389

SCHEMBL29005389

O=C(Cc1c(F)cccc1Cl)Nc1cnnc(Cl)c1.O=C(Cc1ccc(F)cc1Cl)Nc1cnnc(Cl)c1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.54
▸ KMT2A Q03164 4/20 0.53
▸ TSHR P16473 1/20 0.53
▸ NPSR1 Q6W5P4 1/20 0.53
▸ LMNA P02545 2/20 0.48
▸ RAB9A P51151 5/20 0.46
▸ NPC1 O15118 4/20 0.46
▸ ALDH1A1 P00352 3/20 0.45
▸ MAPT P10636 2/20 0.44
▸ POLB P06746 2/20 0.44
▸ MAPK8 P45983 1/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ HTT P42858 1/20 0.44
▸ RECQL P46063 1/20 0.44

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
SCHEMBL26186443 0.91 SMN1; SMN2 (0.64) SMN1; SMN2KMT2ATSHRNPSR1LMNA
SCHEMBL30285766 0.91 SMN1; SMN2 (0.64) SMN1; SMN2KMT2ATSHRNPSR1LMNA
SCHEMBL30285583 0.89 ROCK2 (0.49) ALDH1A1POLBRECQL
SCHEMBL26186442 0.89 ROCK2 (0.49) ALDH1A1POLBRECQL
SCHEMBL26186438 0.82 RECQL (0.59) SMN1; SMN2KMT2ATSHRNPSR1LMNA
SCHEMBL30285701 0.82 RECQL (0.59) SMN1; SMN2KMT2ATSHRNPSR1LMNA
SCHEMBL29005545 0.81 SMN1; SMN2 (0.60) SMN1; SMN2KMT2ATSHRNPSR1LMNA
SCHEMBL30285857 0.81 SMN1; SMN2 (0.60) SMN1; SMN2KMT2ATSHRNPSR1LMNA
SCHEMBL24173309 0.80 SMN1; SMN2 (0.56) SMN1; SMN2KMT2ATSHRNPSR1LMNA
SCHEMBL29005502 0.80 KMT2A (0.58) SMN1; SMN2KMT2ATSHRNPSR1LMNA

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
CN-115996911-A Substituted N-phenylacetamides having P2X4 receptor antagonistic activity 拜耳公司 2023-04-21 — — CN claimed
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