SCHEMBL29852291

SCHEMBL29852291

N#Cc1ccc(OCc2ccc(NC(=O)Cc3c(F)cccc3Cl)cc2S(N)(=O)=O)cc1

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ P2RX4 Q99571 14/20 0.59
▸ SMN1; SMN2 Q16637 2/20 0.51
▸ MEN1 O00255 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ LMNA P02545 1/20 0.43
▸ 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
SCHEMBL24685985 1.00 P2RX4 (0.59) P2RX4SMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL24686058 0.91 P2RX4 (0.63) P2RX4SMN1; SMN2
SCHEMBL29852275 0.91 P2RX4 (0.63) P2RX4SMN1; SMN2
SCHEMBL29852100 0.89 P2RX4 (0.57) P2RX4
SCHEMBL24686711 0.89 P2RX4 (0.57) P2RX4
SCHEMBL24686433 0.87 P2RX4 (0.61) P2RX4
SCHEMBL29852342 0.87 P2RX4 (0.61) P2RX4
SCHEMBL24685959 0.86 P2RX4 (0.59) P2RX4SMN1; SMN2KMT2AMAPT
SCHEMBL30629443 0.86 P2RX4 (0.59) P2RX4SMN1; SMN2KMT2AMAPT
SCHEMBL24685986 0.85 SMN1; SMN2 (0.52) P2RX4SMN1; SMN2MEN1ALDH1A1KMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116635020-A Aromatic compound, preparation method and application thereof 武汉朗来科技发展有限公司 2023-08-22 — — CN disclosed
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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