SCHEMBL695870

SCHEMBL695870

Cc1cccc([C@H](C)c2nccn2Cc2ccc(F)cc2F)c1C

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.38
ADRA2C P18825 1/20 0.37
KCNH2 Q12809 3/20 0.36
MAPK14 Q16539 2/20 0.36
TDP1 Q9NUW8 1/20 0.35
CYP2D6 P10635 1/20 0.35
TSHR P16473 1/20 0.35
CYP2C19 P33261 1/20 0.35
HIF1A Q16665 1/20 0.35
P2RX7 Q99572 2/20 0.35
PTGER3 P43115 1/20 0.35
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL696898 0.91 KCNH2 (0.38) ADRA2CKCNH2TDP1CYP2D6TSHR
SCHEMBL696426 0.89 CYP2D6 (0.45) KCNH2TDP1CYP2D6TSHRCYP2C19
SCHEMBL697415 0.89 CYP2D6 (0.45) PPARGADRA2CKCNH2TDP1CYP2D6
SCHEMBL3530799 0.89 ADRA2C (0.38) ADRA2CKCNH2TDP1CYP2D6TSHR
SCHEMBL698377 0.87 ADRA2C (0.44) ADRA2CKCNH2TDP1KDM4E
SCHEMBL698285 0.87 P2RX7 (0.42) ADRA2CKCNH2TDP1CYP2D6TSHR
SCHEMBL695821 0.86 KCNH2 (0.37) ADRA2CKCNH2TDP1CYP2D6TSHR
SCHEMBL702942 0.85 P2RX7 (0.44) ADRA2CKCNH2TDP1CYP2D6TSHR
SCHEMBL697757 0.84 TDP1 (0.41) TDP1ALDH1A1
SCHEMBL697058 0.84 ADRA2C (0.40) ADRA2CKCNH2TDP1CYP2D6TSHR

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 PPARG 2423/4885ADRA2C 144/4885KCNH2 277/4885
US-20090312326-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 PPARG 2423/4885ADRA2C 144/4885KCNH2 277/4885
US-20070167506-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 PPARG 2423/4885ADRA2C 144/4885KCNH2 277/4885
US-20080119536-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 PPARG 2423/4885ADRA2C 144/4885KCNH2 277/4885

“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.