SCHEMBL696351

SCHEMBL696351

Cc1ccc(Cl)cc1Cn1ccnc1[C@@H](C)c1cccc(C)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
ADRA2C P18825 1/20 0.40
KCNH2 Q12809 5/20 0.39
TDP1 Q9NUW8 1/20 0.36
BRD4 O60885 1/20 0.35
TP53 P04637 1/20 0.35
P2RX7 Q99572 2/20 0.34
HSP90AA1 P07900 1/20 0.33
HSP90B1 P14625 1/20 0.33
KMT2A Q03164 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
SCHEMBL697925 0.92 CYP2D6 (0.47) CYP2D6TSHRCYP2C19HIF1AADRA2C
SCHEMBL697415 0.88 CYP2D6 (0.45) CYP2D6TSHRCYP2C19HIF1AADRA2C
SCHEMBL697205 0.86 TDP1 (0.44) CYP2D6TSHRCYP2C19HIF1AKCNH2
SCHEMBL697585 0.86 ADRA2C (0.53) TSHRADRA2CTDP1P2RX7HSP90AA1
SCHEMBL697336 0.85 BRD4 (0.49) CYP2D6TSHRCYP2C19HIF1AKCNH2
SCHEMBL696426 0.81 CYP2D6 (0.45) CYP2D6TSHRCYP2C19HIF1AKCNH2
SCHEMBL698656 0.81 KCNH2 (0.42) CYP2D6TSHRCYP2C19HIF1AADRA2C
SCHEMBL696898 0.81 KCNH2 (0.38) CYP2D6TSHRCYP2C19HIF1AADRA2C
SCHEMBL697196 0.81 ADRA2C (0.39) CYP2D6TSHRCYP2C19HIF1AADRA2C
SCHEMBL696289 0.81 TDP1 (0.54) CYP2D6CYP2C19ADRA2CKCNH2TDP1

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.