SCHEMBL3467560

SCHEMBL3467560

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

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ HSD17B10 Q99714 2/20 0.34
▸ TSHR P16473 2/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ NAPRT Q6XQN6 1/20 0.34
▸ MRGPRX4 Q96LA9 1/20 0.34
▸ SLC40A1 Q9NP59 4/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ KMO O15229 1/20 0.32
▸ HRH4 Q9H3N8 1/20 0.32
▸ GCK P35557 1/20 0.32
▸ LMNA P02545 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ FFAR4 Q5NUL3 1/20 0.31
▸ GSK3B P49841 1/20 0.31
▸ SLC6A7 Q99884 1/20 0.31

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
SCHEMBL3467323 0.77 LOX (0.46) ALDH1A1HSD17B10TSHRTDP1NAPRT
SCHEMBL2566196 0.77 LOXL2 (0.46) SYKALDH1A1HSD17B10TSHRTDP1
Hydrochloric Acid SCHEMBL27991102 0.75 LOXL2 (0.47) SYKALDH1A1HSD17B10TSHRTDP1
SCHEMBL24998589 0.74 TRPV1 (0.34) SYKSMN1; SMN2KMONPC1RAB9A
SCHEMBL28280585 0.74 MAPT (0.36) ALDH1A1TSHRKDM4ESMN1; SMN2KMO
SCHEMBL23674532 0.73 CA1 (0.39) SLC40A1
SCHEMBL29774730 0.73 ALDH1A1 (0.43) ALDH1A1HSD17B10TSHRTDP1NAPRT
SCHEMBL1072803 0.73 ALDH1A1 (0.43) ALDH1A1HSD17B10TSHRTDP1NAPRT
SCHEMBL2304236 0.72 KDM4C (0.50) SYKALDH1A1MRGPRX4KDM4EKMO
SCHEMBL20916908 0.71 ABL1 (0.42) SYKKDM4ENPC1RAB9A

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
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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