SCHEMBL8749765

SCHEMBL8749765

CC(C)N(C(C)C)S(=O)(=O)c1[c]cccc1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.36
ALDH1A1 P00352 3/20 0.33
KDM4E B2RXH2 2/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
VCAM1 P19320 1/20 0.33
FPR1 P21462 1/20 0.32
HSD17B10 Q99714 1/20 0.32
ESR1 P03372 1/20 0.32
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31
LMNA P02545 1/20 0.30
PSIP1 O75475 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL182586 0.79 ALDH1A1 (0.40) SMN1; SMN2ALDH1A1KDM4EMAPTMEN1
SCHEMBL2730023 0.78 PTGS1 (0.32)
SCHEMBL1014627 0.77 ALDH1A1 (0.33) ALDH1A1MAPTFPR1HSD17B10MEN1
SCHEMBL159759 0.75 PSIP1 (0.46) GAAPSIP1
SCHEMBL8749746 0.74 HTT (0.46) SMN1; SMN2ALDH1A1KDM4EMAPTNPC1
SCHEMBL7709101 0.74 MAOA (0.33)
SCHEMBL11565032 0.74
SCHEMBL77668 0.74 PTGS2 (0.33) PSIP1
SCHEMBL150811 0.73 HTR6 (0.38) GAAMEN1KMT2A
SCHEMBL3664285 0.73 ALDH1A1 (0.33) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5663386-A REACTION WITH AQUEOUS ALKALINE SOLUTION PRODUCES COLOR WHICH PASSES INTO AQUEOUS PHASE BASF AKTIENGESELLSCHAFT (DE) 1997-09-02 US disclosed
EP-0689575-B1 ANTHRAQUINONES AS MARKING AGENTS FOR MINERAL OILS BASF AG (DE) 1997-02-05 EP disclosed
EP-0689575-A1 ANTHRAQUINONES AS MARKING AGENTS FOR MINERAL OILS BASF AG (DE) 1996-01-03 EP disclosed
WO-1994021752-A1 ANTHRAQUINONES AS MARKING AGENTS FOR MINERAL OILS BASF AKTIENGESELLSCHAFT (DE) 1994-09-29 WO disclosed
EP-0076212-B1 A METHOD FOR PREPARING 1-ARYL-3-ARYLAMINO-2-PYRAZOLIN-5-ONES EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1986-09-03 EP disclosed
EP-0076212-A2 A method for preparing 1-aryl-3-arylamino-2-pyrazolin-5-ones EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1983-04-06 EP disclosed
US-4374253-A Method for preparing 1-aryl-3-arylamino-2-pyrazolin-5-ones from N-aryl-3-arylamino-3-oximinopropionamides EASTMAN KODAK COMPANY (US) 1983-02-15 US disclosed