SCHEMBL3267534

SCHEMBL3267534

Cc1ccc(F)c2c1C(O)CCO2

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAP3K14 Q99558 2/20 0.53
CHRM2 P08172 11/20 0.37
CHRM1 P11229 11/20 0.37
RRM1 P23921 11/20 0.37
RRM2B Q7LG56 11/20 0.37
ADRA2A P08913 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
SLC6A3 Q01959 1/20 0.32
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31

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
SCHEMBL3267103 0.87 MAP3K14 (0.44) MAP3K14CHRM2CHRM1RRM1RRM2B
SCHEMBL21752405 0.81 MAP3K14 (0.40) MAP3K14CHRM2CHRM1RRM1RRM2B
SCHEMBL19906410 0.79 MAP3K14 (0.42) MAP3K14CHRM2CHRM1RRM1RRM2B
SCHEMBL8135027 0.74 ADRA2A (0.33) MAP3K14ADRA2A
SCHEMBL12705522 0.74 MAP3K14 (0.33) MAP3K14CHRM2CHRM1RRM1RRM2B
SCHEMBL18688711 0.73 MAP3K14 (0.39) MAP3K14
SCHEMBL4755702 0.71 ADRA2A (0.50) MAP3K14ADRA2A
SCHEMBL22143945 0.71 ADRA2A (0.50) MAP3K14ADRA2A
SCHEMBL13506581 0.71 MAP3K14 (0.47) MAP3K14ADRA2A
SCHEMBL20132605 0.71 MAP3K14 (0.36) MAP3K14CHRM2CHRM1RRM1RRM2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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.