SCHEMBL2566196

SCHEMBL2566196

O=S(=O)(O)c1ccnc(C(F)(F)F)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LOXL2 Q9Y4K0 2/20 0.46
▸ LOX P28300 1/20 0.44
▸ SMARCA2 P51531 1/20 0.43
▸ SMARCA4 P51532 1/20 0.43
▸ SYK P43405 1/20 0.41
▸ KCNQ2 O43526 1/20 0.40
▸ NOTUM Q6P988 1/20 0.39
▸ IDO1 P14902 1/20 0.39
▸ AR P10275 1/20 0.39
▸ HDAC4 P56524 1/20 0.38
▸ ALDH1A1 P00352 2/20 0.37
▸ HSD17B10 Q99714 2/20 0.37
▸ TSHR P16473 2/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ NAPRT Q6XQN6 1/20 0.37
▸ RORC P51449 1/20 0.37
▸ DDR1 Q08345 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ MRGPRX4 Q96LA9 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.35

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
Hydrochloric Acid SCHEMBL27991102 0.98 LOXL2 (0.47) LOXL2LOXSMARCA2SMARCA4SYK
SCHEMBL15454569 0.81 SMARCA2 (0.46) LOXL2LOXSMARCA2SMARCA4KCNQ2
SCHEMBL30015071 0.81 SMARCA2 (0.46) LOXL2LOXSMARCA2SMARCA4KCNQ2
SCHEMBL5700160 0.81 SYK (0.47) LOXL2LOXSYKARALDH1A1
SCHEMBL28923971 0.77 BRAF (0.45) SYKNOTUMIDO1
SCHEMBL29774730 0.77 ALDH1A1 (0.43) ALDH1A1HSD17B10TSHRTDP1NAPRT
SCHEMBL1072803 0.77 ALDH1A1 (0.43) ALDH1A1HSD17B10TSHRTDP1NAPRT
SCHEMBL3467560 0.77 SYK (0.34) SYKALDH1A1HSD17B10TSHRTDP1
SCHEMBL21020612 0.77 HRH4 (0.47) LOXL2LOXSMARCA2SMARCA4KCNQ2
SCHEMBL8847160 0.74 ALDH1A1 (0.41) ALDH1A1HSD17B10TSHRTDP1NAPRT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2382190-A1 TOLUIDINE SULFONAMIDES AND THEIR USE AS-INHIBITORS European Molecular Biology Laboratory (EMBL) (DE) 2011-11-02 — — EP disclosed
WO-2010085968-A1 TOLUIDINE SULFONAMIDES AND THEIR USE AS HIF-INHIBITORS EUROPEAN MOLECULAR BIOLOGY LABORATORY (EMBL) (DE) 2010-08-05 — — WO disclosed
WO-2010076034-A1 TOLUIDINE SULFONAMIDES AND THEIR USE AS-INHIBITORS EUROPEAN MOLECULAR BIOLOGY LABORATORY (EMBL) (DE) 2010-07-08 — — WO disclosed
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