SCHEMBL24686376

SCHEMBL24686376

O=C(Cc1cc(F)ccc1Cl)Nc1ccc(COc2cc[nH]n2)c(Br)c1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ANO1 Q5XXA6 3/20 0.46
▸ P2RX4 Q99571 5/20 0.44
▸ P2RX7 Q99572 3/20 0.41
▸ BRD4 O60885 1/20 0.40
▸ SGMS2 Q8NHU3 1/20 0.40
▸ RECQL P46063 1/20 0.40
▸ KCNJ5 P48544 2/20 0.38
▸ KCNJ3 P48549 2/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ ROCK2 O75116 1/20 0.37
▸ EGFR P00533 1/20 0.37
▸ ERBB2 P04626 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.36

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
SCHEMBL24686385 0.93 RECQL (0.45) ANO1P2RX4P2RX7RECQLKCNJ5
SCHEMBL24686770 0.87 ANO1 (0.48) ANO1P2RX4P2RX7BRD4SGMS2
SCHEMBL24687294 0.81 ANO1 (0.43) ANO1P2RX4P2RX7BRD4SGMS2
SCHEMBL24687103 0.80 RECQL (0.53) ANO1P2RX4P2RX7RECQLKCNJ5
SCHEMBL24686769 0.79 ANO1 (0.51) ANO1P2RX4P2RX7BRD4KCNJ5
SCHEMBL24687037 0.78 RECQL (0.49) P2RX4RECQLKCNJ5KCNJ3SMN1; SMN2
SCHEMBL24687090 0.77 ADAMTS4 (0.51) ANO1P2RX4P2RX7RECQLKCNJ5
SCHEMBL24686726 0.77 P2RX4 (0.54) P2RX4BRD4KCNJ5KCNJ3SMN1; SMN2
SCHEMBL24686674 0.75 KCNJ5 (0.54) P2RX4KCNJ5KCNJ3
SCHEMBL30629430 0.74 P2RX4 (0.56) ANO1P2RX4RECQL

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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