SCHEMBL1905103

SCHEMBL1905103

Cc1c(C(=O)O)c(C(=O)O)c2cccc(C)c2c1C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 2/20 0.45
PDE10A Q9Y233 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
KDM4E B2RXH2 3/20 0.40
ALDH1A1 P00352 2/20 0.40
HPGD P15428 2/20 0.40
HSD17B10 Q99714 2/20 0.40
TSHR P16473 1/20 0.39
KMT2A Q03164 3/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
CYP1A2 P05177 2/20 0.38
CYP2A6 P11509 1/20 0.38
DHODH Q02127 2/20 0.38
CA12 O43570 2/20 0.38
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38

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
SCHEMBL8731892 0.85 MCL1 (0.45) MCL1PDE10ATDP1L3MBTL1KDM4E
SCHEMBL1666642 0.81 BRPF1 (0.41) MCL1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL28217579 0.81 MCL1 (0.41) MCL1PDE10ATDP1L3MBTL1KDM4E
SCHEMBL2937057 0.78 BRPF1 (0.41) MCL1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL9170208 0.77 CA12 (0.52) PDE10ATDP1KDM4EALDH1A1HPGD
SCHEMBL27754085 0.76 ALDH1A1 (0.37) MCL1TDP1L3MBTL1KDM4EALDH1A1
SCHEMBL19203148 0.76 LDHA (0.49) MCL1TDP1L3MBTL1KDM4EALDH1A1
SCHEMBL497403 0.76 PDE10A (0.52) PDE10ATDP1KDM4EALDH1A1HPGD
SCHEMBL31128390 0.76 PDE10A (0.52) PDE10ATDP1KDM4EALDH1A1HPGD
SCHEMBL3078467 0.75 TDP1 (0.40) MCL1PDE10ATDP1L3MBTL1KDM4E

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-8906187-B2 Method of making shoulder/nozzles with film barrier liners COLGATE-PALMOLIVE COMPANY (US) 2014-12-09 US disclosed
CN-102066090-B Method of making shoulder/nozzle with membrane barrier liner COLGATE PALMOLIVE CO 2014-09-17 CN disclosed
EP-2321114-B1 METHOD OF MAKING SHOULDER/NOZZELS WITH FILM BARRIER LINERS COLGATE PALMOLIVE CO (US) 2013-12-11 EP disclosed
EP-2321114-A1 METHOD OF MAKING SHOULDER/NOZZELS WITH FILM BARRIER LINERS Colgate-Palmolive Company (US) 2011-05-18 EP disclosed
CN-102066090-A Method of making shoulder/nozzle with membrane barrier liner COLGATE PALMOLIVE CO 2011-05-18 CN disclosed
US-20090324864-A1 Method of Making Shoulder/Nozzles With Film Barrier Liners COLGATE-PALMOLIVE (US) 2009-12-31 US disclosed
WO-2009157931-A1 METHOD OF MAKING SHOULDER/NOZZELS WITH FILM BARRIER LINERS COLGATE-PALMOLIVE COMPANY (US) 2009-12-30 WO disclosed