SCHEMBL24686385

SCHEMBL24686385

O=C(Cc1ccc(F)cc1Cl)Nc1ccc(COc2cc[nH]n2)c(Br)c1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ RECQL P46063 1/20 0.45
▸ P2RX4 Q99571 2/20 0.44
▸ ROCK2 O75116 1/20 0.43
▸ P2RX7 Q99572 9/20 0.43
▸ MEN1 O00255 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ ANO1 Q5XXA6 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ ADAMTS4 O75173 1/20 0.38
▸ MMP2 P08253 1/20 0.38
▸ MMP13 P45452 1/20 0.38
▸ MMP14 P50281 1/20 0.38
▸ ADAMTS5 Q9UNA0 1/20 0.38
▸ KCNJ5 P48544 1/20 0.37
▸ KCNJ3 P48549 1/20 0.37
▸ ACKR3 P25106 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
SCHEMBL24686376 0.93 ANO1 (0.46) RECQLP2RX4ROCK2P2RX7ANO1
SCHEMBL24687103 0.86 RECQL (0.53) RECQLP2RX4ROCK2P2RX7MEN1
SCHEMBL24687090 0.84 ADAMTS4 (0.51) RECQLP2RX4ROCK2P2RX7MEN1
SCHEMBL24687283 0.81 ROCK2 (0.45) RECQLP2RX4ROCK2P2RX7MEN1
SCHEMBL24686770 0.80 ANO1 (0.48) RECQLP2RX4ROCK2P2RX7ANO1
SCHEMBL24687088 0.79 ROCK2 (0.49) RECQLP2RX4ROCK2P2RX7MEN1
SCHEMBL24686030 0.79 ROCK2 (0.49) RECQLP2RX4ROCK2P2RX7MEN1
SCHEMBL24687037 0.79 RECQL (0.49) RECQLP2RX4ROCK2KCNJ5KCNJ3
SCHEMBL24686736 0.77 RECQL (0.53) RECQLP2RX4ROCK2P2RX7MEN1
SCHEMBL24686674 0.76 KCNJ5 (0.54) P2RX4KCNJ5KCNJ3

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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