SCHEMBL696208

SCHEMBL696208

Cc1cccc([C@H](C)c2nccn2Cc2ccc3ccccc3c2)c1C

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.41
KMT2A Q03164 2/20 0.40
CYP19A1 P11511 1/20 0.40
LMNA P02545 1/20 0.39
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
HTR2B P41595 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C19 P33261 1/20 0.38
KCNH2 Q12809 1/20 0.37
TNIK Q9UKE5 1/20 0.36
GRM2 Q14416 1/20 0.36
ADRA2C P18825 1/20 0.35

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
SCHEMBL696289 0.86 TDP1 (0.54) TDP1KMT2ALMNACYP1A2CYP2D6
SCHEMBL695900 0.86 TDP1 (0.54) TDP1KMT2ALMNACYP1A2CYP2D6
SCHEMBL703762 0.84 TDP1 (0.44) TDP1KMT2ALMNACYP1A2CYP2D6
SCHEMBL696282 0.84 KCNH2 (0.39) TDP1LMNAKCNH2GRM2
SCHEMBL697360 0.84 FSCN1 (0.44) TDP1LMNAKCNH2
SCHEMBL697359 0.84 TDP1 (0.47) TDP1KMT2ACYP19A1LMNACYP1A2
SCHEMBL698555 0.83 TDP1 (0.41) TDP1KMT2ALMNACYP1A2CYP2D6
SCHEMBL697205 0.83 TDP1 (0.44) TDP1KMT2ALMNACYP1A2CYP2D6
SCHEMBL697382 0.83 TDP1 (0.47) TDP1KMT2ALMNACYP1A2CYP2D6
SCHEMBL696260 0.83 TDP1 (0.47) TDP1KMT2ALMNACYP1A2CYP2D6

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 TDP1 2820/4885KMT2A 945/4885CYP19A1 1985/4885
US-20090312326-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 TDP1 2820/4885KMT2A 945/4885CYP19A1 1985/4885
US-20070167506-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 TDP1 2820/4885KMT2A 945/4885CYP19A1 1985/4885
US-20080119536-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 TDP1 2820/4885KMT2A 945/4885CYP19A1 1985/4885

“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.