SCHEMBL6546744

SCHEMBL6546744

CC(=Cc1ccccc1)c1ccccc1C(C)C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.42
ALDH1A1 P00352 1/20 0.42
AKR1C3 P42330 1/20 0.42
GABRA1 P14867 2/20 0.42
GABRB2 P47870 2/20 0.42
RARB P10826 1/20 0.42
RARG P13631 1/20 0.42
RXRA P19793 1/20 0.42
RXRB P28702 1/20 0.42
RXRG P48443 1/20 0.42
NISCH Q9Y2I1 1/20 0.40
FBP1 P09467 1/20 0.39
BRD4 O60885 1/20 0.39
CREBBP Q92793 1/20 0.39
FAAH O00519 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
LMNA P02545 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39

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
SCHEMBL7715071 0.83 TSHR (0.52) TSHRALDH1A1AKR1C3NISCHFBP1
SCHEMBL11203024 0.76 MAPT (0.47) TSHRALDH1A1AKR1C3NISCHFBP1
SCHEMBL10973737 0.76 MAPT (0.47) TSHRALDH1A1AKR1C3NISCHFBP1
SCHEMBL30495367 0.76 MAPT (0.47) TSHRALDH1A1AKR1C3NISCHFBP1
SCHEMBL21808157 0.74 MAPT (0.49) TSHRALDH1A1AKR1C3NISCHFBP1
SCHEMBL21340590 0.74 TSHR (0.44) TSHRALDH1A1AKR1C3NISCHFBP1
SCHEMBL21808158 0.74 MAPT (0.49) TSHRALDH1A1AKR1C3NISCHFBP1
SCHEMBL1537421 0.72 GABRA1 (0.54) TSHRGABRA1GABRB2FAAHCA1
SCHEMBL9442849 0.72 NR4A1 (0.50) TSHRALDH1A1AKR1C3BRD4CREBBP
SCHEMBL6546872 0.72 MEN1 (0.47) TSHRALDH1A1AKR1C3RARBRARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4283568-A Process for the recovery of phenol from a reaction mixture resulting from the acid cleavage of cumene hydroperoxide UOP INC. (US) 1981-08-11 US claimed
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