SCHEMBL702850

SCHEMBL702850

Cc1cccc([C@H](C)c2nccn2Cc2cccc(OC(F)(F)F)c2)c1C

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 4/20 0.51
KCNN4 O15554 8/20 0.40
TDP1 Q9NUW8 1/20 0.40
P2RX7 Q99572 1/20 0.39
LMNA P02545 1/20 0.39
DRD4 P21917 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C19 P33261 1/20 0.37
SCD O00767 1/20 0.37
MAOB P27338 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
SCHEMBL698068 0.89 TDP1 (0.40) KCNH2TDP1P2RX7LMNACYP1A2
SCHEMBL697382 0.87 TDP1 (0.47) TDP1P2RX7LMNACYP1A2CYP2D6
SCHEMBL696260 0.87 TDP1 (0.47) TDP1P2RX7LMNACYP1A2CYP2D6
SCHEMBL698162 0.84 TDP1 (0.45) TDP1LMNACYP1A2CYP2D6CYP2C19
SCHEMBL697239 0.84 MAPT (0.46) KCNH2KCNN4TDP1P2RX7LMNA
SCHEMBL697350 0.84 TDP1 (0.41) KCNH2TDP1LMNACYP1A2CYP2D6
SCHEMBL697757 0.83 TDP1 (0.41) TDP1LMNA
SCHEMBL704400 0.82 TDP1 (0.46) TDP1LMNACYP1A2CYP2D6CYP2C19
SCHEMBL696289 0.81 TDP1 (0.54) KCNH2TDP1LMNACYP1A2CYP2D6
SCHEMBL695900 0.81 TDP1 (0.54) KCNH2TDP1LMNACYP1A2CYP2D6

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 KCNH2 277/4885KCNN4 687/4885TDP1 2820/4885
US-20090312326-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 KCNH2 277/4885KCNN4 687/4885TDP1 2820/4885
US-20070167506-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 KCNH2 277/4885KCNN4 687/4885TDP1 2820/4885
US-20080119536-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 KCNH2 277/4885KCNN4 687/4885TDP1 2820/4885

“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.