SCHEMBL15994580

SCHEMBL15994580

CCCc1ccc(C)c(Cl)c1O

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PRKCI P41743 1/20 0.44
▸ TYR P14679 2/20 0.41
▸ ELANE P08246 2/20 0.37
▸ CTSG P08311 1/20 0.37
▸ ALOX5 P09917 4/20 0.35
▸ CYP3A4 P08684 2/20 0.32
▸ TSHR P16473 1/20 0.32
▸ RECQL P46063 1/20 0.32
▸ HMGCR P04035 1/20 0.32
▸ CHRM1 P11229 1/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ MAOA P21397 1/20 0.32
▸ TBXA2R P21731 1/20 0.32
▸ ADRA1A P35348 1/20 0.32
▸ HTR2B P41595 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ HTT P42858 1/20 0.32

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
SCHEMBL13862920 0.83 PRKCI (0.52) PRKCITYRELANECTSGHMGCR
SCHEMBL15994814 0.83 GABRA1 (0.48) CYP3A4CHRM1ALOX15MAOATBXA2R
SCHEMBL5676907 0.81 PRKCI (0.48) PRKCITYRELANECTSGALOX5
SCHEMBL5709273 0.79 TYR (0.52) PRKCITYRELANECTSGALOX5
SCHEMBL5590177 0.78 PRKCI (0.57) PRKCITYRELANECTSGALOX5
SCHEMBL23387415 0.78 PRKCI (0.46) PRKCITYRELANECTSGALOX5
SCHEMBL20121310 0.76 CTSL (0.34) PRKCI
SCHEMBL3826144 0.75 PRKCI (0.43) PRKCITYRELANECTSGALOX5
SCHEMBL7631085 0.75 HTR1D (0.44) PRKCITYRELANECTSGALOX5
SCHEMBL23387422 0.74 TYR (0.55) PRKCITYRELANECTSGALOX5

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-2961373-A2 ORAL CARE COMPOSITIONS JOHNSON & JOHNSON CONSUMER INC. (US) 2016-01-06 — — EP disclosed
EP-2961372-A2 ORAL CARE COMPOSITIONS JOHNSON & JOHNSON CONSUMER INC. (US) 2016-01-06 — — EP disclosed
WO-2014133744-A2 ORAL CARE COMPOSITIONS MCNEIL-PPC, INC. (US) 2014-09-04 — — WO disclosed
WO-2014133746-A2 ORAL CARE COMPOSITIONS MCNEIL-PPC, INC. (US) 2014-09-04 — — WO disclosed
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