SCHEMBL8938115

SCHEMBL8938115

NC(=O)C(OCCN(Cc1ccccc1)CC(O)c1cccc(C(F)(F)F)c1)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NR1H3 Q13133 4/20 0.51
TRPM8 Q7Z2W7 1/20 0.46
EPHX1 P07099 3/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
PNMT P11086 1/20 0.43
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
GAA P10253 1/20 0.40
ACP3 P15309 1/20 0.40
SLC1A5 Q15758 1/20 0.39
CETP P11597 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
SCHEMBL8938121 0.83 NR1H3 (0.51) NR1H3TRPM8EPHX1MEN1KMT2A
SCHEMBL5347609 0.81 NR1H3 (0.64) NR1H3TRPM8MEN1KMT2APNMT
SCHEMBL5347613 0.81 NR1H3 (0.64) NR1H3TRPM8MEN1KMT2APNMT
Hydrochloric Acid SCHEMBL8938094 0.76 PNMT (0.49) EPHX1MEN1KMT2APNMTKDM4E
SCHEMBL6539998 0.73 RORC (0.42) NR1H3TRPM8MEN1KMT2AKDM4E
SCHEMBL6540005 0.73 RORC (0.42) NR1H3TRPM8MEN1KMT2AKDM4E
SCHEMBL10822323 0.72 PNMT (0.49) NR1H3TRPM8EPHX1PNMTACP3
SCHEMBL10822325 0.72 PNMT (0.49) NR1H3TRPM8EPHX1PNMTACP3
SCHEMBL22817596 0.72 CNR2 (0.58) TRPM8MEN1KMT2APNMTKDM4E
SCHEMBL22817603 0.72 CNR2 (0.58) TRPM8MEN1KMT2APNMTKDM4E

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-5502078-A Chemical compounds ZENECA LIMITED (GB) 1996-03-26 US disclosed