SCHEMBL6546168

SCHEMBL6546168

CC=Cc1c(C)cccc1-c1ccccc1CC

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ DHFR P00374 1/20 0.37
▸ CXCR5 P32302 1/20 0.36
▸ CSNK2A2 P19784 1/20 0.36
▸ CSNK2B P67870 1/20 0.36
▸ CSNK2A1 P68400 1/20 0.36
▸ CSNK2A3 Q8NEV1 1/20 0.36
▸ GABRA1 P14867 2/20 0.34
▸ GABRB2 P47870 2/20 0.34
▸ KCNN4 O15554 1/20 0.33
▸ PTGS2 P35354 1/20 0.33
▸ PKM P14618 1/20 0.33
▸ FFAR1 O14842 1/20 0.33
▸ FFAR4 Q5NUL3 1/20 0.33
▸ CYP3A4 P08684 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ DAO P14920 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ S1PR4 O95977 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
SCHEMBL6546843 0.78 MYC (0.36) DHFRCSNK2A2CSNK2BCSNK2A1CSNK2A3
SCHEMBL6547246 0.78 MYC (0.36) DHFRCSNK2A2CSNK2BCSNK2A1CSNK2A3
SCHEMBL6546152 0.77 CSNK2A2 (0.36) DHFRCSNK2A2CSNK2BCSNK2A1CSNK2A3
SCHEMBL26707956 0.76 GABRA1 (0.46) GABRA1GABRB2DAO
SCHEMBL29078453 0.76 GABRA1 (0.46) GABRA1GABRB2DAO
SCHEMBL5599467 0.76 CSNK2A2 (0.49) DHFRCSNK2A2CSNK2BCSNK2A1CSNK2A3
SCHEMBL8611383 0.75 CSNK2A2 (0.39) DHFRCSNK2A2CSNK2BCSNK2A1CSNK2A3
SCHEMBL8611388 0.75 CSNK2A2 (0.39) DHFRCSNK2A2CSNK2BCSNK2A1CSNK2A3
SCHEMBL6548166 0.75 KDM4E (0.40) CXCR5PTGS2LMNA
SCHEMBL8537937 0.74 P2RX7 (0.45) DHFRCSNK2A2CSNK2BCSNK2A1CSNK2A3

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-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
Send feedback