SCHEMBL6547015

SCHEMBL6547015

CCC(C)c1ccc(Cc2ccccc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CALM1 P0DP23 1/20 0.50
LTA4H P09960 2/20 0.45
TAAR1 Q96RJ0 3/20 0.44
TSHR P16473 2/20 0.43
ALDH1A1 P00352 1/20 0.43
TRPA1 O75762 2/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
LMNA P02545 1/20 0.42
SLC7A5 Q01650 1/20 0.42
TP53 P04637 1/20 0.41

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
SCHEMBL5665155 0.88 MAOA (0.45) TAAR1TSHRALDH1A1TRPA1NPC1
SCHEMBL13053149 0.87 ALDH1A1 (0.39) CALM1TAAR1TSHRALDH1A1TRPA1
SCHEMBL6547480 0.83 ACHE (0.43) TSHRALDH1A1NPC1RAB9A
SCHEMBL10178571 0.82 ALDH1A1 (0.40) TAAR1TSHRALDH1A1TRPA1NPC1
SCHEMBL10178438 0.82 TSHR (0.56) TSHRALDH1A1NPC1RAB9ASLC7A5
SCHEMBL4443642 0.82 TAAR1 (0.61) TAAR1TSHRALDH1A1TRPA1LMNA
Benzene SCHEMBL5290987 0.82 TAAR1 (0.61) TAAR1TSHRALDH1A1TRPA1LMNA
SCHEMBL136376 0.82 TAAR1 (0.61) TAAR1TSHRALDH1A1TRPA1LMNA
SCHEMBL17453236 0.82 TAAR1 (0.61) TAAR1TSHRALDH1A1TRPA1LMNA
SCHEMBL25868780 0.82 ESR1 (0.62) TAAR1ALDH1A1NPC1RAB9ALMNA

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-5711895-A Fluid composition for use in a refrigerating machine in which the refrigerating machine oil is at least one hydrocarbon compound of a formula consisting of two phenyl groups joined through an alkylene or alkenylene group NIPPON OIL CO., LTD. (JP) 1998-01-27 US claimed
JP-62234983-A None JP disclosed
EP-0717098-B1 A refrigerating machine oil and a fluid composition for use in a refrigerating machine NIPPON MITSUBISHI OIL CORP (JP) 2004-01-21 EP disclosed
US-5817251-A AROMATIC HYDROCARBON LUBRICANT NIPPON OIL CO., LTD. (JP) 1998-10-06 US disclosed
US-5711895-A Fluid composition for use in a refrigerating machine in which the refrigerating machine oil is at least one hydrocarbon compound of a formula consisting of two phenyl groups joined through an alkylene or alkenylene group NIPPON OIL CO., LTD. (JP) 1998-01-27 US disclosed
EP-0717098-A2 A refrigerating machine oil and a fluid composition for use in a refrigerating machine NIPPON OIL CO. LTD. (JP) 1996-06-19 EP disclosed
JP-S62234983-A PRESSURE-SENSITIVE COPY MATERIAL NIPPON PETROCHEM CO LTD 1987-10-15 JP disclosed