SCHEMBL11296078

SCHEMBL11296078

Cc1cc(O)n(-c2ccc(Cl)cc2)c(=O)c1S(=O)(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.44
MAPT P10636 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.39
NOTUM Q6P988 1/20 0.38
KDM4E B2RXH2 2/20 0.38
GRM1 Q13255 4/20 0.38
MPL P40238 1/20 0.37
ALDH1A1 P00352 3/20 0.37
MIF P14174 1/20 0.36
HPD P32754 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
CHRNA7 P36544 1/20 0.35
MC4R P32245 1/20 0.35
OPRK1 P41145 1/20 0.35
RAB9A P51151 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
SCHEMBL11443266 0.85 LMNA (0.45) POLBMAPTNOTUMKDM4EMPL
SCHEMBL11651603 0.75 KDM4E (0.58) POLBMAPTKDM4EALDH1A1MEN1
SCHEMBL11310457 0.74 LMNA (0.45) MAPTNOTUMKDM4EMPLALDH1A1
SCHEMBL7890105 0.72 KDM4E (0.41) POLBKDM4EALDH1A1MEN1KMT2A
SCHEMBL11410806 0.70 MYC (0.49) POLBNOTUMKDM4EALDH1A1CYP3A4
SCHEMBL11417116 0.70 F2 (0.33) KDM4ENPSR1
SCHEMBL6875333 0.68 KDM4E (0.40) POLBMAPTSMN1; SMN2KDM4EALDH1A1
SCHEMBL11316417 0.68 LMNA (0.44) POLBALDH1A1CYP1A2CYP3A4CYP2C19
SCHEMBL9401741 0.68 CYP2C19 (0.36) MAPTMPLALDH1A1CYP2C19MEN1
SCHEMBL10955294 0.67 ALDH1A1 (0.37) POLBMAPTSMN1; SMN2KDM4EALDH1A1

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-0013936-B1 REACTIVE AZO DYESTUFFS, THEIR PREPARATION AND THEIR USE IN DYEING MATERIALS CONTAINING HYDROXYL GROUPS AND AMIDE GROUPS BAYER AG (DE) 1982-09-22 EP disclosed
US-4299764-A Azo reactive dyestuffs BAYER AKTIENGESELLSCHAFT (DE) 1981-11-10 US disclosed
EP-0013936-A1 Reactive azo dyestuffs, their preparation and their use in dyeing materials containing hydroxyl groups and amide groups BAYER AG (DE) 1980-08-06 EP disclosed