SCHEMBL8679290

SCHEMBL8679290

CCc1ccccc1C(C)(c1ccccc1CC)c1cccc(CC)c1CC

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 4/20 0.43
GABRB2 P47870 4/20 0.43
TAAR1 Q96RJ0 2/20 0.34
HTR1A P08908 1/20 0.34
MGLL Q99685 1/20 0.32
KCNA5 P22460 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
PDK2 Q15119 1/20 0.32
CTSB P07858 1/20 0.32
KCNH2 Q12809 1/20 0.32
SCN5A Q14524 1/20 0.32
LMNA P02545 1/20 0.31

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
SCHEMBL23044955 0.78 GABRA1 (0.45) GABRA1GABRB2TAAR1HTR1AKCNA5
SCHEMBL27845874 0.78 GABRA1 (0.41) GABRA1GABRB2TAAR1HTR1AKCNA5
SCHEMBL25771233 0.76 GABRA1 (0.46) GABRA1GABRB2TAAR1PDK2SCN5A
SCHEMBL9344023 0.76 GABRA1 (0.46) GABRA1GABRB2TAAR1HTR1AMGLL
SCHEMBL982446 0.75 GABRA1 (0.47) GABRA1GABRB2HTR1AALDH1A1
SCHEMBL16105766 0.74 GABRA1 (0.48) GABRA1GABRB2MGLLALDH1A1MAPT
SCHEMBL1521882 0.74 GABRA1 (0.48) GABRA1GABRB2MGLLALDH1A1MAPT
SCHEMBL2230699 0.74 GABRA1 (0.41) GABRA1GABRB2TAAR1KCNA5ALDH1A1
SCHEMBL9000240 0.74 GABRA1 (0.52) GABRA1GABRB2TAAR1HTR1AMGLL
Chloromethane SCHEMBL27971188 0.74 GABRA1 (0.59) GABRA1GABRB2TAAR1HTR1AMGLL

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-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