SCHEMBL697869

SCHEMBL697869

Cc1cccc([C@H](C)c2nccn2C(=O)OC[C@H](C)c2ccccc2)c1C

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 1/20 0.36
OPRK1 P41145 1/20 0.36
MAPK14 Q16539 1/20 0.34
MEN1 O00255 4/20 0.33
KMT2A Q03164 4/20 0.33
FFAR1 O14842 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ABCB1 P08183 3/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
HPGD P15428 1/20 0.32
CYP2C19 P33261 1/20 0.32
LMNA P02545 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
PTGDR2 Q9Y5Y4 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
SCHEMBL697870 1.00 OPRD1 (0.36) OPRD1OPRK1MAPK14MEN1KMT2A
SCHEMBL698760 0.93 FFAR1 (0.35) OPRD1OPRK1MAPK14MEN1KMT2A
SCHEMBL697994 0.88 TSHR (0.40) MEN1KMT2AL3MBTL1CYP1A2CYP3A4
SCHEMBL697019 0.88 TSHR (0.40) MEN1KMT2AL3MBTL1CYP1A2CYP3A4
SCHEMBL699093 0.87 ALDH1A1 (0.40) MEN1KMT2AKDM4ECYP1A2CYP3A4
SCHEMBL696535 0.86 KMT2A (0.34) MEN1KMT2ACYP1A2CYP3A4CYP2C9
SCHEMBL698609 0.85 KMT2A (0.34) MAPK14MEN1KMT2ACYP1A2CYP3A4
SCHEMBL698613 0.85 KMT2A (0.34) MEN1KMT2AFFAR1CYP1A2CYP3A4
SCHEMBL697760 0.85 L3MBTL1 (0.38) OPRD1OPRK1MEN1KMT2AFFAR1
SCHEMBL698612 0.85 KMT2A (0.34) MEN1KMT2AFFAR1CYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2423199-A1 Substituted imidazoles and their use as pesticides Pfizer Limited (GB) 2012-02-29 EP disclosed
US-7825149-B2 Substituted imidazoles PFIZER LIMITED (GB) 2010-11-02 US disclosed
US-20090312326-A1 SUBSTITUTED IMIDAZOLES PFIZER LIMITED (GB) 2009-12-17 US disclosed
US-7592362-B2 Substituted imidazoles PFIZER LIMITED (GB) 2009-09-22 US disclosed
US-7547718-B2 Substituted imidazoles PFIZER LIMITED (GB) 2009-06-16 US disclosed
US-7544706-B2 Substituted imidazoles PFIZER LIMITED (GB) 2009-06-09 US disclosed
US-20080125473-A1 SUBSTITUTED IMIDAZOLES PFIZER LIMITED (GB) 2008-05-29 US disclosed
US-20080119536-A1 SUBSTITUTED IMIDAZOLES PFIZER LIMITED (GB) 2008-05-22 US disclosed
US-20070167506-A1 SUBSTITUTED IMIDAZOLES PFIZER INC. (US) 2007-07-19 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080125473-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 OPRD1 1759/4885OPRK1 1806/4885MAPK14 3258/4885
US-20090312326-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 OPRD1 1759/4885OPRK1 1806/4885MAPK14 3258/4885
US-20070167506-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 OPRD1 1759/4885OPRK1 1806/4885MAPK14 3258/4885
US-20080119536-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 OPRD1 1759/4885OPRK1 1806/4885MAPK14 3258/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.