SCHEMBL22210792

SCHEMBL22210792

CCC(C)(C)Oc1ccc(-c2ccc(C)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIT P10721 1/20 0.39
ACHE P22303 1/20 0.38
TRPM8 Q7Z2W7 1/20 0.37
S1PR1 P21453 1/20 0.35
S1PR3 Q99500 1/20 0.35
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
KMT2A Q03164 1/20 0.34
PPARA Q07869 3/20 0.34
CYP3A4 P08684 2/20 0.34
TSHR P16473 2/20 0.34
PPARG P37231 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
ABCB11 O95342 1/20 0.34
CYP1A2 P05177 1/20 0.34
HTR2A P28223 1/20 0.34
PMP22 Q01453 1/20 0.34
MMP12 P39900 1/20 0.34
ALOX5 P09917 1/20 0.33
TEAD4 Q15561 1/20 0.33

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
SCHEMBL18478570 0.94 ACHE (0.42) ACHETRPM8KMT2APPARACYP3A4
SCHEMBL22645661 0.92 PPARA (0.36) KITNPC1RAB9APPARACYP3A4
SCHEMBL12164642 0.86 RIPK1 (0.36) KITNPC1RAB9APPARACYP3A4
SCHEMBL133972 0.85 TSHR (0.41) NPC1RAB9AKMT2APPARACYP3A4
SCHEMBL13703536 0.85 TSHR (0.40) ACHETRPM8NPC1RAB9AKMT2A
SCHEMBL17453656 0.84 ESR2 (0.47) ACHENPC1RAB9ATSHRSCN10A
SCHEMBL12164682 0.84 PPARA (0.33) KITNPC1RAB9AKMT2APPARA
SCHEMBL13892865 0.82 S1PR1 (0.40) KITS1PR1PPARATSHRPPARG
SCHEMBL12606789 0.80 GAA (0.53) ACHEKMT2ANPSR1
SCHEMBL12608151 0.80 LMNA (0.53) ACHETRPM8RAB9AKMT2APPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10711103-B2 DCPD-derived polyether and method of producing the same NATIONAL CHUNG SAN INSTITUTE OF SCIENCE AND TECHNOLOGY (TW) 2020-07-14 US disclosed