SCHEMBL696426

SCHEMBL696426

Cc1cccc([C@H](C)c2nccn2Cc2ccc(F)cc2Cl)c1C

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.45
TSHR P16473 1/20 0.45
CYP2C19 P33261 1/20 0.45
HIF1A Q16665 1/20 0.45
P2RX7 Q99572 11/20 0.43
KCNH2 Q12809 2/20 0.39
ATM Q13315 2/20 0.39
ALDH1A1 P00352 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
RAB9A P51151 1/20 0.38
TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL695870 0.89 PPARG (0.38) CYP2D6TSHRCYP2C19HIF1AP2RX7
SCHEMBL696898 0.87 KCNH2 (0.38) CYP2D6TSHRCYP2C19HIF1AP2RX7
SCHEMBL698285 0.85 P2RX7 (0.42) CYP2D6TSHRCYP2C19HIF1AP2RX7
SCHEMBL697415 0.85 CYP2D6 (0.45) CYP2D6TSHRCYP2C19HIF1AKCNH2
SCHEMBL697196 0.85 ADRA2C (0.39) CYP2D6TSHRCYP2C19HIF1AP2RX7
SCHEMBL697990 0.84 TDP1 (0.46) CYP2D6CYP2C19P2RX7KCNH2L3MBTL1
SCHEMBL702942 0.83 P2RX7 (0.44) CYP2D6TSHRCYP2C19HIF1AP2RX7
SCHEMBL697925 0.83 CYP2D6 (0.47) CYP2D6TSHRCYP2C19HIF1AP2RX7
SCHEMBL697757 0.82 TDP1 (0.41) ALDH1A1TDP1
SCHEMBL3530799 0.82 ADRA2C (0.38) CYP2D6TSHRCYP2C19HIF1AP2RX7

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 CYP2D6 15/4885TSHR 3443/4885CYP2C19 16/4885
US-20090312326-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 CYP2D6 15/4885TSHR 3443/4885CYP2C19 16/4885
US-20070167506-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 CYP2D6 15/4885TSHR 3443/4885CYP2C19 16/4885
US-20080119536-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 CYP2D6 15/4885TSHR 3443/4885CYP2C19 16/4885

“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.