SCHEMBL6697979

SCHEMBL6697979

CC(=O)Nc1cccc(C)c1O

nearest known ligand 0.68

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.68
HPGD P15428 3/20 0.68
HSD17B10 Q99714 3/20 0.50
MAPK1 P28482 2/20 0.50
ALOX15 P16050 1/20 0.50
MAPT P10636 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
POLB P06746 3/20 0.49
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
EPHX1 P07099 1/20 0.47
KDM4E B2RXH2 2/20 0.47
MAOA P21397 1/20 0.46
CYP2C19 P33261 1/20 0.46
TRPA1 O75762 1/20 0.45
GAA P10253 1/20 0.45
PARP14 Q460N5 1/20 0.44

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
SCHEMBL4959475 0.87 ALDH1A1 (0.59) ALDH1A1HPGDHSD17B10MAPK1ALOX15
SCHEMBL30702637 0.82 ALDH1A1 (0.70) ALDH1A1HPGDHSD17B10MAPTPOLB
SCHEMBL2307143 0.82 ALDH1A1 (0.70) ALDH1A1HPGDHSD17B10MAPTPOLB
SCHEMBL19004112 0.82 ALDH1A1 (0.53) ALDH1A1HPGDHSD17B10MAPK1ALOX15
SCHEMBL10517748 0.81 HPGD (1.00) ALDH1A1HPGDHSD17B10MAPK1SMN1; SMN2
SCHEMBL96123 0.81 HPGD (1.00) ALDH1A1HPGDHSD17B10MAPK1SMN1; SMN2
SCHEMBL11424223 0.80 ALDH1A1 (0.68) ALDH1A1HPGDHSD17B10MAPK1POLB
SCHEMBL14817806 0.79 ALDH1A1 (0.65) ALDH1A1HPGDHSD17B10MAPK1MAPT
SCHEMBL23705971 0.78 RXFP1 (0.51) ALDH1A1HPGDHSD17B10MAPK1ALOX15
SCHEMBL909725 0.78 HSD17B10 (0.56) ALDH1A1HPGDHSD17B10MAPK1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0950669-B1 Method of catalytic crosslinking of polymers and two-pack composition used therein ROHM & HAAS (US) 2004-09-08 EP disclosed
US-6306991-B1 TWO PART COATING COMPOSITION WITH TWO CONTAINERS, OXIDATIVE POLYMERS WITH CROSSLINKABLE FUNCTIONAL GROUPS ROHM AND HAAS COMPANY 2001-10-23 US disclosed
US-6149977-A CONTACTING THE OXIDATIVE POLYMER WITH A CATALYTIC AMOUNT OF AN OXIDIZING ENZYME, SUCH AS HORSERADISH PEROXIDASE. ROHM AND HAAS COMPANY (US) 2000-11-21 US disclosed
EP-0950669-A2 Method of catalytic crosslinking of polymers and two-pack composition used therein ROHM AND HAAS COMPANY (US) 1999-10-20 EP disclosed