SCHEMBL697084

SCHEMBL697084

Cc1cccc([C@H](C)c2nccn2C(=O)OCCCC2CCCC2)c1C

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 1/20 0.36
CYSLTR1 Q9Y271 1/20 0.36
CHRM2 P08172 4/20 0.35
CHRM4 P08173 4/20 0.35
CHRM5 P08912 4/20 0.35
CHRM1 P11229 4/20 0.35
CHRM3 P20309 4/20 0.35
NAAA Q02083 7/20 0.34
ASAH1 Q13510 1/20 0.33
BMP1 P13497 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
TSHR P16473 1/20 0.33
OPRD1 P41143 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
SCHEMBL703518 0.99 CYSLTR2 (0.38) CYSLTR2CYSLTR1CHRM2CHRM4CHRM5
SCHEMBL698575 0.96 NAAA (0.38) NAAAASAH1
SCHEMBL698498 0.93 CHRM2 (0.35) CYSLTR2CYSLTR1CHRM2CHRM4CHRM5
SCHEMBL697567 0.90 SSTR4 (0.33) CHRM4TSHR
SCHEMBL695810 0.88 GUCY1B2 (0.36) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL698409 0.87 GUCY1B2 (0.37) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL698544 0.86 JMJD6 (0.37) TSHROPRD1
SCHEMBL698638 0.85 BCHE (0.38) TDP1TSHROPRD1
SCHEMBL699055 0.84 ALDH1A1 (0.34) TDP1
SCHEMBL697147 0.84 GPR119 (0.36) TSHR

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 CYSLTR2 2635/4885CYSLTR1 3160/4885CHRM2 831/4885
US-20090312326-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 CYSLTR2 2635/4885CYSLTR1 3160/4885CHRM2 831/4885
US-20070167506-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 CYSLTR2 2635/4885CYSLTR1 3160/4885CHRM2 831/4885
US-20080119536-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 CYSLTR2 2635/4885CYSLTR1 3160/4885CHRM2 831/4885

“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.