SCHEMBL698832

SCHEMBL698832

Cc1cccc([C@H](C)c2nccn2Cc2ccncc2)c1C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.44
LMNA P02545 1/20 0.40
KMT2A Q03164 2/20 0.39
CYP1A2 P05177 2/20 0.39
CYP2D6 P10635 2/20 0.39
CYP2C19 P33261 2/20 0.39
ADRA2C P18825 5/20 0.38
ADRA2A P08913 4/20 0.38
ADRA2B P18089 4/20 0.38
ADRA1A P35348 3/20 0.38
ADRA1B P35368 3/20 0.38
ADRA1D P25100 2/20 0.38
KCNH2 Q12809 2/20 0.38
TP53 P04637 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
TSHR P16473 1/20 0.38
SLC6A2 P23975 1/20 0.37
HTR7 P34969 1/20 0.37
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL695900 0.91 TDP1 (0.54) TDP1LMNAKMT2ACYP1A2CYP2D6
SCHEMBL696289 0.91 TDP1 (0.54) TDP1LMNAKMT2ACYP1A2CYP2D6
SCHEMBL703762 0.90 TDP1 (0.44) TDP1LMNAKMT2ACYP1A2CYP2D6
SCHEMBL697205 0.89 TDP1 (0.44) TDP1LMNAKMT2ACYP1A2CYP2D6
SCHEMBL698831 0.88 TDP1 (0.43) TDP1LMNAKMT2ACYP1A2CYP2D6
SCHEMBL697990 0.88 TDP1 (0.46) TDP1LMNACYP1A2CYP2D6CYP2C19
SCHEMBL696014 0.87 TDP1 (0.41) TDP1LMNAKMT2AKCNH2ALDH1A1
SCHEMBL703605 0.87 TDP1 (0.41) TDP1LMNAKMT2AKCNH2ALDH1A1
SCHEMBL697359 0.86 TDP1 (0.47) TDP1LMNAKMT2ACYP1A2CYP2D6
SCHEMBL698793 0.86 KMT2A (0.50) TDP1LMNAKMT2ACYP1A2CYP2D6

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 2820/4885LMNA 3030/4885KMT2A 945/4885
US-20090312326-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 TDP1 2820/4885LMNA 3030/4885KMT2A 945/4885
US-20070167506-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 TDP1 2820/4885LMNA 3030/4885KMT2A 945/4885
US-20080119536-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 TDP1 2820/4885LMNA 3030/4885KMT2A 945/4885

“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.