SCHEMBL3267103

SCHEMBL3267103

OC1CCOc2c(F)ccc(F)c21

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAP3K14 Q99558 2/20 0.44
CHRM2 P08172 9/20 0.37
CHRM1 P11229 9/20 0.37
RRM1 P23921 8/20 0.37
RRM2B Q7LG56 8/20 0.37
ADRA2A P08913 1/20 0.34
HTR1A P08908 2/20 0.30

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
SCHEMBL3267534 0.87 MAP3K14 (0.53) MAP3K14CHRM2CHRM1RRM1RRM2B
SCHEMBL21752405 0.85 MAP3K14 (0.40) MAP3K14CHRM2CHRM1RRM1RRM2B
SCHEMBL31357913 0.82 HTR1A (0.33) MAP3K14HTR1A
SCHEMBL8135027 0.78 ADRA2A (0.33) MAP3K14ADRA2A
SCHEMBL1265725 0.78 ADRA2A (0.33) CHRM2CHRM1RRM1RRM2BADRA2A
SCHEMBL1265041 0.78 ADRA2A (0.33) CHRM2CHRM1RRM1RRM2BADRA2A
SCHEMBL12705522 0.78 MAP3K14 (0.33) MAP3K14CHRM2CHRM1RRM1RRM2B
SCHEMBL19906410 0.77 MAP3K14 (0.42) MAP3K14CHRM2CHRM1RRM1RRM2B
SCHEMBL22143945 0.76 ADRA2A (0.50) MAP3K14ADRA2AHTR1A
SCHEMBL4755702 0.76 ADRA2A (0.50) MAP3K14ADRA2AHTR1A

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-2435416-B1 TETRAHYDROPYRANOCHROMENE GAMMA SECRETASE INHIBITORS MERCK SHARP & DOHME (US) 2016-03-30 EP disclosed
CN-102321077-A Chromane substituted benzimidazoles and their use as acid pump inhibitors RAQUALIA PHARMA INC 2012-01-18 CN disclosed
CN-101341149-B Chromane-substituted benzimidazoles and their use as acid pump inhibitors RAQUALIA PHARMA INC 2011-06-08 CN disclosed
EP-1963311-B1 CHROMANE SUBSTITUTED BENZIMIDAZOLES AND THEIR USE AS ACID PUMP INHIBITORS RAQUALIA PHARMA INC (JP) 2010-06-16 EP disclosed
US-7723321-B2 Chromane substituted benzimidazole derivatives RAQUALIA PHARMA INC. (JP) 2010-05-25 US disclosed
CN-101341149-A Chromane-substituted benzimidazoles and their use as acid pump inhibitors PFIZER (US) 2009-01-07 CN disclosed
EP-1963311-A1 CHROMANE SUBSTITUTED BENZIMIDAZOLES AND THEIR USE AS ACID PUMP INHIBITORS Pfizer, Inc. (US) 2008-09-03 EP disclosed
WO-2007072146-A1 CHROMANE SUBSTITUTED BENZIMIDAZOLES AND THEIR USE AS ACID PUMP INHIBITORS PFIZER JAPAN INC. (JP) 2007-06-28 WO disclosed
US-20070142448-A1 Chromane Substituted Benzimidazole Derivatives PFIZER INC. 2007-06-21 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-20070142448-A1 Chromane Substituted Benzimidazole Derivatives HRH2, HRH4, HRH1 MAP3K14 2526/4885CHRM2 10/4885CHRM1 4/4885

“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.