SCHEMBL8621271

SCHEMBL8621271

CC(N)C(Cc1ccc(Cl)c(Cl)c1)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FDFT1 P37268 7/20 0.55
PNMT P11086 1/20 0.54
SIGMAR1 Q99720 2/20 0.47
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
CCR2 P41597 2/20 0.39
PTPN5 P54829 1/20 0.38
S1PR4 O95977 1/20 0.38
S1PR1 P21453 1/20 0.38
S1PR3 Q99500 1/20 0.38
S1PR5 Q9H228 1/20 0.38
CSNK2A1 P68400 1/20 0.38
PRCP P42785 1/20 0.38
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
SLC6A3 Q01959 1/20 0.38

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
SCHEMBL8621281 1.00 FDFT1 (0.55) FDFT1PNMTSIGMAR1CYP1A2CYP2C9
SCHEMBL8620429 0.92 FDFT1 (0.47) FDFT1PNMTSIGMAR1CYP1A2CYP2C9
SCHEMBL8622251 0.85 PNMT (0.60) FDFT1PNMTSIGMAR1SLC6A2SLC6A4
Hydrochloric Acid SCHEMBL8623994 0.85 FDFT1 (0.53) FDFT1PNMTSIGMAR1CYP1A2CYP2C9
SCHEMBL8626206 0.85 FDFT1 (0.63) FDFT1PNMTSIGMAR1CYP1A2CYP2C9
SCHEMBL8620804 0.84 FDFT1 (0.53) FDFT1SIGMAR1CYP1A2PRCPSLC6A2
SCHEMBL8625643 0.84 FDFT1 (0.53) FDFT1SIGMAR1CYP1A2PRCPSLC6A2
SCHEMBL8623834 0.84 FDFT1 (0.53) FDFT1SIGMAR1CYP1A2PRCPSLC6A2
SCHEMBL8623070 0.84 FDFT1 (0.53) FDFT1SIGMAR1CYP1A2PRCPSLC6A2
SCHEMBL8625042 0.84 FDFT1 (0.62) FDFT1PNMTCYP1A2CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5777150-A Substituted amic acid derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 1998-07-07 US disclosed
EP-0611749-B1 Substituted amic acid derivatives useful for treatment of arteriosclerosis BANYU PHARMA CO LTD (JP) 1997-10-22 EP disclosed
US-5616803-A EXHIBIT SQUALENE SYNTHASE-INHIBITORY ACTIVITIES; USEFUL IN TREATMENT AND PROPHYLAXIS OF HYPERCHOLESTEREMIA, HYPERLIPEMIA AND ARTERIOSCLEROSIS BANYU PHARMACEUTICAL CO., LTD. (JP) 1997-04-01 US disclosed
US-5606101-A INTERMEDIATES FOR SQUALENE SYNTHASE INHIBITORS BANYU PHARMACEUTICAL CO., LTD. (JP) 1997-02-25 US disclosed
US-5488149-A SQUALENE SYNTHASE INHIBITORS AS ANTICHOLESTEROL OR ANTILIPEMIC AGENTS BANYU PHARMACEUTICAL CO., LTD. (JP) 1996-01-30 US disclosed
EP-0611749-A1 Substituted amic acid derivatives useful for treatment of arteriosclerosis BANYU PHARMACEUTICAL CO., LTD. (JP) 1994-08-24 EP disclosed