SCHEMBL1970740

SCHEMBL1970740

CC(C)(C)OC(=O)C1(CI)CC1

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.43
CYP4A11 Q02928 2/20 0.43
DGAT1 O75907 2/20 0.33
TDP1 Q9NUW8 1/20 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
SCHEMBL31626083 0.81 CYP4F2 (0.49) CYP4F2CYP4A11DGAT1TDP1
SCHEMBL10004678 0.81 CYP4F2 (0.48) CYP4F2CYP4A11DGAT1TDP1
SCHEMBL186963 0.80 CYP4F2 (0.51) CYP4F2CYP4A11DGAT1TDP1
SCHEMBL18044818 0.79 CYP4F2 (0.43) CYP4F2CYP4A11DGAT1TDP1
SCHEMBL186673 0.78 CYP4F2 (0.53) CYP4F2CYP4A11DGAT1TDP1
SCHEMBL798227 0.78 CYP4F2 (0.60) CYP4F2CYP4A11DGAT1TDP1
SCHEMBL797984 0.78 CYP4F2 (0.60) CYP4F2CYP4A11DGAT1TDP1
SCHEMBL798441 0.78 CYP4F2 (0.60) CYP4F2CYP4A11DGAT1TDP1
SCHEMBL14903599 0.78 CYP4F2 (0.46) CYP4F2CYP4A11DGAT1TDP1
SCHEMBL798199 0.78 CYP4F2 (0.60) CYP4F2CYP4A11DGAT1TDP1

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1856110-B1 OXYINDOLE DERIVATIVES AS 5HT4 RECEPTOR AGONISTS PFIZER (US) 2011-06-22 EP disclosed
US-7737163-B2 Benzimidazolone carboxylic acid derivatives PFIZER INC. (US) 2010-06-15 US disclosed
US-7705020-B2 Benzimidazolone carboxylic acid derivatives PFIZER INC. (US) 2010-04-27 US disclosed
US-7595329-B2 Benzimidazolone carboxylic acid derivatives PFIZER INC (US) 2009-09-29 US disclosed
US-7589109-B2 Oxyindole derivatives PFIZER INC (US) 2009-09-15 US disclosed
US-20080108660-A1 Benzimidazolone Carboxylic Acid Derivatives PFIZER INC 2008-05-08 US disclosed
US-20060194842-A1 Oxyindole derivatives PFIZER INC. 2006-08-31 US disclosed
US-20050277671-A1 Benzimidazolone carboxylic acid derivatives PFIZER INC 2005-12-15 US disclosed
US-20050277672-A1 Benzimidazolone carboxylic acid derivatives PFIZER INC 2005-12-15 US disclosed
US-20050277673-A1 Benzimidazolone carboxylic acid derivatives PFIZER JAPAN INC. (JP) 2005-12-15 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 (5 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-20050277673-A1 Benzimidazolone carboxylic acid derivatives HRH2, HRH4, GPR4 CYP4F2 1097/4885CYP4A11 615/4885DGAT1 4189/4885
US-20050277672-A1 Benzimidazolone carboxylic acid derivatives HRH2, HRH4, GPR4 CYP4F2 1097/4885CYP4A11 615/4885DGAT1 4189/4885
US-20060194842-A1 Oxyindole derivatives HTR4, HTR5A, HRH4 CYP4F2 715/4885CYP4A11 422/4885DGAT1 2695/4885
US-20050277671-A1 Benzimidazolone carboxylic acid derivatives HRH2, HRH4, GPR4 CYP4F2 1097/4885CYP4A11 615/4885DGAT1 4189/4885
US-20080108660-A1 Benzimidazolone Carboxylic Acid Derivatives HRH2, HRH4, GPR4 CYP4F2 1184/4885CYP4A11 672/4885DGAT1 4217/4885

“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.