SCHEMBL4110288

SCHEMBL4110288

CN1CCc2cc(F)ccc2C(N)C1=O

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SRD5A1 P18405 5/20 0.46
BRD4 O60885 2/20 0.43
MTNR1B P49286 1/20 0.39
NOTUM Q6P988 1/20 0.39
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
CA9 Q16790 2/20 0.38
CA14 Q9ULX7 2/20 0.38
KMT2A Q03164 1/20 0.36
XIAP P98170 1/20 0.36
OPRM1 P35372 2/20 0.36
OPRK1 P41145 2/20 0.36
OPRL1 P41146 2/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
SLC6A3 Q01959 1/20 0.36
TRPV1 Q8NER1 2/20 0.36
ACKR3 P25106 1/20 0.36
ACHE P22303 1/20 0.36

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
SCHEMBL4115947 1.00 SRD5A1 (0.46) SRD5A1BRD4MTNR1BNOTUMCA1
SCHEMBL4115934 1.00 SRD5A1 (0.46) SRD5A1BRD4MTNR1BNOTUMCA1
SCHEMBL4415385 0.82 SRD5A1 (0.40) SRD5A1MTNR1BNOTUMCA1CA2
SCHEMBL4415387 0.82 SRD5A1 (0.40) SRD5A1MTNR1BNOTUMCA1CA2
SCHEMBL4126331 0.78 XIAP (0.54) SRD5A1BRD4XIAP
SCHEMBL4122057 0.78 XIAP (0.54) SRD5A1BRD4XIAP
SCHEMBL4122465 0.78 XIAP (0.54) SRD5A1BRD4XIAP
Hydrochloric Acid SCHEMBL4114257 0.77 XIAP (0.53) SRD5A1BRD4XIAP
SCHEMBL8032013 0.70 MAOA (0.56) SRD5A1MTNR1BNOTUMSLC6A2SLC6A4
SCHEMBL30242535 0.70 GRM5 (0.56) SRD5A1NOTUMKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8258302-B2 Method for producing benzazepinone API CORPORATION (JP) 2012-09-04 US disclosed
US-20090171090-A1 METHOD FOR PRODUCING BENZAZEPINONE API CORPORATION (JP) 2009-07-02 US disclosed
EP-1985615-A1 METHOD FOR PRODUCING BENZAZEPINONE API Corporation (JP) 2008-10-29 EP 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-20090171090-A1 METHOD FOR PRODUCING BENZAZEPINONE NISCH, GABBR1, GABBR2 SRD5A1 1074/4885BRD4 30/4885MTNR1B 1952/4885

“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.