SCHEMBL9333192

SCHEMBL9333192

CCOC(=O)Nc1cc(S(=O)(=O)O)cc(N)c1O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 1/20 0.47
▸ CYP2C9 P11712 1/20 0.47
▸ CYP2C19 P33261 1/20 0.47
▸ SMN1; SMN2 Q16637 3/20 0.46
▸ CASR P41180 1/20 0.43
▸ HDAC3 O15379 1/20 0.43
▸ HDAC1 Q13547 1/20 0.43
▸ HDAC2 Q92769 1/20 0.43
▸ KCNQ3 O43525 1/20 0.41
▸ KCNQ2 O43526 1/20 0.41
▸ KCNQ4 P56696 1/20 0.41
▸ KCNQ5 Q9NR82 1/20 0.41
▸ ALDH1A1 P00352 7/20 0.41
▸ HPGD P15428 3/20 0.40
▸ RECQL P46063 2/20 0.39
▸ HSD17B10 Q99714 2/20 0.39
▸ LMNA P02545 1/20 0.39
▸ NSD2 O96028 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ PLCG1 P19174 1/20 0.39

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
SCHEMBL343266 0.79 CASR (0.58) CYP2C9CYP2C19CASRHDAC3HDAC1
SCHEMBL5720587 0.78 APEX1 (0.56) CYP1A2CYP2C9CYP2C19SMN1; SMN2ALDH1A1
SCHEMBL10429504 0.78 CASR (0.56) CYP2C9CYP2C19CASRHDAC3HDAC1
SCHEMBL28785155 0.77 NLRP3 (0.56) CYP1A2CYP2C9CYP2C19SMN1; SMN2ALDH1A1
SCHEMBL7825237 0.76 CYP1A2 (0.45) CYP1A2CYP2C9CYP2C19SMN1; SMN2ALDH1A1
SCHEMBL11692298 0.75 SMN1; SMN2 (0.52) CYP1A2CYP2C9CYP2C19SMN1; SMN2CASR
SCHEMBL8591227 0.72 HSD17B10 (0.55) CYP1A2CYP2C9CYP2C19SMN1; SMN2HDAC3
SCHEMBL5720482 0.72 CYP1A2 (0.47) CYP1A2CYP2C9CYP2C19SMN1; SMN2ALDH1A1
SCHEMBL5720688 0.72 NT5E (0.45) CYP1A2CYP2C9CYP2C19SMN1; SMN2ALDH1A1
SCHEMBL10524356 0.71 CISD1 (0.42) CASRALDH1A1HSD17B10NSD2GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9952173-B2 Lead ion sensors, methods of making and uses thereof TONGJI UNIVERSITY (CN) 2018-04-24 — — US disclosed
US-20160231271-A1 LEAD ION SENSORS, METHODS OF MAKING AND USES THEREOF TONGJI UNIVERSITY (CN) 2016-08-11 — — US disclosed
WO-2015042971-A1 LEAD ION SENSORS, METHODS OF MAKING AND USES THEREOF TONGJI UNIVERSITY (CN) 2015-04-02 — — WO disclosed
EP-0402318-B1 Method of preparing fibre reactive formazane compounds CIBA GEIGY AG (CH) 1994-04-20 — — EP disclosed
EP-0402318-A2 Method of preparing fibre reactive formazane compounds CIBA-GEIGY AG (CH) 1990-12-12 — — EP disclosed
Send feedback