SCHEMBL695952

SCHEMBL695952

Cc1cccc(C(C)c2nccn2COC(=O)N(C)Cc2ccccc2)c1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 1/20 0.43
CHRNB4 P30926 1/20 0.43
CHRNA3 P32297 1/20 0.43
CHRNA4 P43681 1/20 0.43
TDP1 Q9NUW8 1/20 0.38
KMT2A Q03164 3/20 0.37
FAAH O00519 3/20 0.37
CNR1 P21554 2/20 0.37
CNR2 P34972 2/20 0.37
MEN1 O00255 2/20 0.36
ALDH1A1 P00352 2/20 0.36
APOBEC3A P31941 1/20 0.36
CA12 O43570 1/20 0.36
CA9 Q16790 1/20 0.36
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
HPGD P15428 1/20 0.35
LMNA P02545 1/20 0.35
PKM P14618 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL697894 0.91 TDP1 (0.37) TDP1KMT2AFAAHMEN1NPC1
SCHEMBL696323 0.83 SMN1; SMN2 (0.38) TDP1KMT2AMEN1ALDH1A1LMNA
SCHEMBL696322 0.82 ALDH1A1 (0.38) TDP1KMT2AMEN1ALDH1A1NPC1
SCHEMBL696999 0.81 ALDH1A1 (0.37) TDP1KMT2AMEN1ALDH1A1NPC1
SCHEMBL696897 0.79 ALDH1A1 (0.38) TDP1KMT2AMEN1ALDH1A1NPC1
SCHEMBL697395 0.79 IDH1 (0.38) KMT2AMEN1ALDH1A1NPC1RAB9A
SCHEMBL696927 0.79 ALDH1A1 (0.35) TDP1KMT2AMEN1ALDH1A1NPC1
SCHEMBL698569 0.79 GLA (0.38) TDP1KMT2AMEN1ALDH1A1NPC1
SCHEMBL3528743 0.79 ALDH1A1 (0.35) TDP1KMT2AMEN1ALDH1A1NPC1
SCHEMBL698624 0.79 ALDH1A1 (0.35) TDP1KMT2AMEN1ALDH1A1NPC1

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 CHRNB2 3898/4885CHRNB4 4073/4885CHRNA3 2683/4885
US-20090312326-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 CHRNB2 3898/4885CHRNB4 4073/4885CHRNA3 2683/4885
US-20070167506-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 CHRNB2 3898/4885CHRNB4 4073/4885CHRNA3 2683/4885
US-20080119536-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 CHRNB2 3898/4885CHRNB4 4073/4885CHRNA3 2683/4885

“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.