SCHEMBL31138255

SCHEMBL31138255

CS(=O)(=O)c1ccnc(-c2cccnc2)n1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.63
▸ POLB P06746 1/20 0.63
▸ CYP2A6 P11509 2/20 0.53
▸ CYP1A2 P05177 6/20 0.52
▸ SMN1; SMN2 Q16637 2/20 0.52
▸ CYP3A4 P08684 5/20 0.49
▸ CYP2C19 P33261 3/20 0.49
▸ CYP2C9 P11712 1/20 0.49
▸ CYP2D6 P10635 4/20 0.48
▸ CLK4 Q9HAZ1 4/20 0.48
▸ ALDH1A1 P00352 3/20 0.48
▸ HSD17B10 Q99714 3/20 0.48
▸ TSHR P16473 1/20 0.48
▸ TDP1 Q9NUW8 2/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ PTGS2 P35354 2/20 0.47
▸ ALOX15 P16050 2/20 0.46
▸ MAPT P10636 2/20 0.46
▸ HTT P42858 2/20 0.46
▸ KDM4E B2RXH2 1/20 0.46

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
SCHEMBL5352445 0.83 L3MBTL1 (0.44) LMNAPOLBCYP1A2SMN1; SMN2CYP3A4
SCHEMBL10817963 0.75 CYP2A6 (0.62) LMNACYP2A6CYP1A2SMN1; SMN2CYP3A4
SCHEMBL3572760 0.73 HSP90AA1 (0.57) LMNAPOLBCYP2A6CYP1A2CYP3A4
SCHEMBL27877200 0.71 CYP2A6 (0.62) LMNAPOLBCYP2A6CYP1A2SMN1; SMN2
SCHEMBL29933915 0.71 CYP2A6 (0.62) LMNAPOLBCYP2A6CYP1A2SMN1; SMN2
SCHEMBL15966607 0.71 CYP2A6 (0.62) LMNAPOLBCYP2A6CYP1A2SMN1; SMN2
SCHEMBL15972704 0.71 CYP2A6 (0.62) LMNACYP2A6CYP1A2SMN1; SMN2CYP3A4
SCHEMBL4631413 0.71 CYP2A6 (0.62) LMNAPOLBCYP2A6CYP1A2SMN1; SMN2
SCHEMBL18905348 0.71 CYP2A6 (0.62) LMNACYP2A6CYP1A2SMN1; SMN2CYP3A4
SCHEMBL16320822 0.71 CYP2A6 (0.62) LMNACYP2A6CYP1A2SMN1; SMN2CYP3A4

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
EP-4685141-A1 ISOINDOLINE DERIVATIVE, BENZOINDOLE DERIVATIVE AND USE THEREOF Shanghai Helioson Pharmaceutical Co., Ltd. (CN) 2026-01-28 — — EP disclosed
WO-2024193641-A1 ISOINDOLINE DERIVATIVE, BENZOINDOLE DERIVATIVE AND USE THEREOF 上海超阳药业有限公司 2024-09-26 — — WO disclosed
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