SCHEMBL7602162

SCHEMBL7602162

CP(O)Cc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.43
TP53 P04637 1/20 0.43
CALM1 P0DP23 1/20 0.41
TDP1 Q9NUW8 2/20 0.40
ALDH1A1 P00352 5/20 0.39
IDO1 P14902 2/20 0.39
THRB P10828 1/20 0.39
CES2 O00748 1/20 0.39
CES1 P23141 1/20 0.39
AKR1B1 P15121 1/20 0.39
LOXL2 Q9Y4K0 1/20 0.38
TRPA1 O75762 1/20 0.38
KDM4E B2RXH2 2/20 0.37
CYP3A4 P08684 1/20 0.37
MAPT P10636 1/20 0.37
NOS2 P35228 1/20 0.37

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
SCHEMBL2129272 0.78 TSHR (0.48) TSHRTP53CALM1TDP1ALDH1A1
SCHEMBL1304376 0.78 TSHR (0.48) TSHRTP53CALM1TDP1ALDH1A1
SCHEMBL9007220 0.78 TP53 (0.48) TSHRTP53CALM1TDP1ALDH1A1
SCHEMBL1357485 0.78 TSHR (0.48) TSHRTP53CALM1TDP1ALDH1A1
SCHEMBL29637107 0.76 TP53 (0.46) TSHRTP53CALM1TDP1ALDH1A1
Bromide SCHEMBL8601709 0.76 TSHR (0.46) TSHRTP53CALM1TDP1ALDH1A1
Hydrochloric Acid SCHEMBL30473262 0.76 TSHR (0.46) TSHRTP53CALM1TDP1ALDH1A1
SCHEMBL9862032 0.75 TP53 (0.46) TSHRTP53CALM1TDP1ALDH1A1
SCHEMBL11884686 0.75 CALM1 (0.47) TSHRTP53CALM1TDP1ALDH1A1
SCHEMBL16687835 0.74 LOXL2 (0.43) TSHRTP53CALM1ALDH1A1IDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0743059-B1 Antibacterial oral composition for applying to dental implant areas COLGATE PALMOLIVE CO (US) 2002-12-04 EP disclosed
US-6096293-A APPLYING ORAL COMPOSITION CONTAINING 2,4-DI-TERT-BUTYL PHENOL TO TEETH COLGATE-PALMOLIVE COMPANY (US) 2000-08-01 US disclosed
EP-0676948-B1 ANTIPLAQUE, ANTIGINGIVITIS, ANTICARIES ORAL COMPOSITION COLGATE PALMOLIVE CO (US) 2000-06-21 EP disclosed
US-5912274-A WATER INSOLUBLE NONCATIONIC ANTIBACTERIAL PHENOL CONTAINING, RELATIVE TO THE HYDROXYL GROUP, AN ALKYL OR CYCLOALKYL GROUP, PREFERABLY TERT.-BUTYL (T-BUTYL), IN THE 2-POSITION, AND SUBSTITUENTS IN ONE OR BOTH OF THE 4- AND 5-POSITIONS COLGATE-PALMOLIVE COMPANY (US) 1999-06-15 US disclosed
EP-0852486-A2 ANTIPLAQUE ORAL COMPOSITION Colgate-Palmolive Company (US) 1998-07-15 EP disclosed
US-5723500-A WATER INSOLUBLE, NONCATIONIC, ANTIBACTERIAL, STERICALLY HINDERED PHENOL; MOUTHWASHES, DENTIFRICES COLGATE-PALMOLIVE COMPANY (US) 1998-03-03 US disclosed
WO-1997010800-A2 ANTIPLAQUE ORAL COMPOSITION COLGATE-PALMOLIVE COMPANY (US) 1997-03-27 WO disclosed
EP-0743059-A2 Process for applying antibacterial oral composition to dental implant areas Colgate-Palmolive Company (US) 1996-11-20 EP disclosed
US-5575652-A Process for applying antibacterial oral composition to dental implant areas COLGATE PALMOLIVE COMPANY (US) 1996-11-19 US disclosed
US-5525330-A CONTAINING N-METHYLPYRROLIDONE ALONE OR IN COMBINATION WITHNONCATIONIC ANTIBACTERIAL AGENT COLGATE PALMOLIVE COMPANY (US) 1996-06-11 US disclosed
EP-0628302-A2 Oral composition containing salicylanilide antibacterial agent Colgate-Palmolive Company (US) 1994-12-14 EP disclosed
US-5368844-A N-methylpyrrolidone COLGATE PALMOLIVE COMPANY (US) 1994-11-29 US disclosed
US-5275805-A Inhibitors of plaque in mouths with mixtures of salicylanilide and nonionic surfactants COLGATE-PALMOLIVE CO. 1994-01-04 US disclosed