SCHEMBL697855

SCHEMBL697855

COc1ccc(Cl)c(C(C)(O)c2ncc[nH]2)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.40
ADRA1A P35348 3/20 0.39
ADRA2A P08913 2/20 0.39
ADRA2C P18825 2/20 0.39
ADRA1D P25100 2/20 0.39
ADRA1B P35368 2/20 0.39
TYK2 P29597 2/20 0.34
HPGDS O60760 1/20 0.34
BRAF P15056 1/20 0.34
TLK2 Q86UE8 2/20 0.34
MMP12 P39900 1/20 0.33
DYRK1A Q13627 1/20 0.33
MDM2 Q00987 1/20 0.33
MAPK1 P28482 2/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
MAPT P10636 1/20 0.33
MEN1 O00255 2/20 0.32

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
SCHEMBL698443 0.90 CYP19A1 (0.40) CYP19A1ADRA1AADRA2AADRA2CADRA1D
SCHEMBL697816 0.83 CYP19A1 (0.51) CYP19A1MDM2MAPK1ALDH1A1CYP1A2
SCHEMBL696482 0.83 CYP19A1 (0.44) CYP19A1ADRA1AADRA2AADRA2CADRA1D
SCHEMBL28775053 0.78 CYP19A1 (0.40) CYP19A1BRAFMDM2
SCHEMBL6299558 0.77 CYP19A1 (0.46) CYP19A1ADRA1AADRA2AADRA2CADRA1D
SCHEMBL698375 0.76 CYP19A1 (0.40) CYP19A1ADRA1AADRA2AADRA2CADRA1D
SCHEMBL27733474 0.76 CYP19A1 (0.47) CYP19A1ADRA1AADRA2AADRA2CADRA1D
SCHEMBL11670141 0.76 CYP19A1 (0.41) CYP19A1BRAFMAPK1ALDH1A1CYP1A2
SCHEMBL7914818 0.75 CYP19A1 (0.51) CYP19A1MDM2MAPK1ALDH1A1CYP1A2
SCHEMBL697512 0.75 CYP19A1 (0.51) CYP19A1MDM2MAPK1ALDH1A1CYP1A2

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 4 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
EP-1981853-B1 SUBSTITUTED IMIDAZOLES AND THEIR USE AS PESTICIDES PFIZER LTD (GB) 2011-04-13 EP disclosed
US-7592362-B2 Substituted imidazoles PFIZER LIMITED (GB) 2009-09-22 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 (1 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-20070167506-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 CYP19A1 1985/4885ADRA1A 498/4885ADRA2A 456/4885

“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.