SCHEMBL24686743

SCHEMBL24686743

Cc1cc(OCc2ccc(NC(=O)Cc3ccccc3Cl)cc2Br)ccc1F

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KCNJ5 P48544 6/20 0.48
▸ KCNJ3 P48549 6/20 0.48
▸ KCNJ6 P48051 2/20 0.47
▸ LMNA P02545 2/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ POLB P06746 1/20 0.47
▸ THRB P10828 1/20 0.47
▸ P2RX4 Q99571 11/20 0.46
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ MAOB P27338 1/20 0.44
▸ MAPT P10636 1/20 0.43

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
SCHEMBL24687256 0.89 KCNJ5 (0.47) KCNJ5KCNJ3KCNJ6LMNAALDH1A1
SCHEMBL24685943 0.89 P2RX4 (0.48) KCNJ5KCNJ3P2RX4MEN1KMT2A
SCHEMBL24686054 0.87 P2RX4 (0.58) KCNJ5KCNJ3KCNJ6LMNAALDH1A1
SCHEMBL29852253 0.87 P2RX4 (0.58) KCNJ5KCNJ3KCNJ6LMNAALDH1A1
SCHEMBL24686674 0.87 KCNJ5 (0.54) KCNJ5KCNJ3KCNJ6P2RX4MAOB
SCHEMBL24685910 0.87 KCNJ5 (0.50) KCNJ5KCNJ3KCNJ6LMNAALDH1A1
SCHEMBL24686639 0.87 KCNJ5 (0.55) KCNJ5KCNJ3KCNJ6ALDH1A1P2RX4
SCHEMBL24686678 0.86 KCNH2 (0.49) KCNJ5KCNJ3P2RX4MAOB
SCHEMBL24687281 0.86 KCNJ5 (0.46) KCNJ5KCNJ3KCNJ6LMNAALDH1A1
SCHEMBL24686619 0.84 P2RX4 (0.46) KCNJ5KCNJ3KCNJ6LMNAALDH1A1

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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