SCHEMBL24687088

SCHEMBL24687088

O=C(Cc1ccc(F)cc1Cl)Nc1ccc(CO)c(Br)c1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ROCK2 O75116 1/20 0.49
▸ P2RX4 Q99571 1/20 0.48
▸ P2RX7 Q99572 5/20 0.47
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ MAPT P10636 1/20 0.46
▸ L3MBTL1 Q9Y468 2/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ LMNA P02545 1/20 0.45
▸ GAA P10253 1/20 0.45
▸ KCNJ5 P48544 3/20 0.44
▸ KCNJ3 P48549 3/20 0.44
▸ RECQL P46063 1/20 0.44
▸ ACKR3 P25106 2/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ POLB P06746 1/20 0.42
▸ ANO1 Q5XXA6 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL24686030 0.90 ROCK2 (0.49) ROCK2P2RX4P2RX7MEN1KMT2A
SCHEMBL24687034 0.85 KCNJ5 (0.61) P2RX4MEN1KMT2AL3MBTL1ALDH1A1
SCHEMBL24687090 0.84 ADAMTS4 (0.51) ROCK2P2RX4P2RX7MEN1KMT2A
SCHEMBL24686679 0.82 RECQL (0.47) ROCK2P2RX4P2RX7MEN1KMT2A
SCHEMBL24686769 0.81 ANO1 (0.51) ROCK2P2RX4P2RX7MEN1KMT2A
SCHEMBL19576777 0.81 P2RX4 (0.61) ROCK2P2RX4
SCHEMBL24687094 0.81 ANO1 (0.52) P2RX4MEN1KMT2AMAPTL3MBTL1
SCHEMBL24687103 0.81 RECQL (0.53) ROCK2P2RX4P2RX7MEN1KMT2A
SCHEMBL24686362 0.80 SMN1; SMN2 (0.58) P2RX4MEN1KMT2AMAPTLMNA
SCHEMBL24687283 0.79 ROCK2 (0.45) ROCK2P2RX4P2RX7MEN1KMT2A

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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