SCHEMBL4123425

SCHEMBL4123425

CCOC(=O)C1=NCCc2cc(F)ccc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.43
MAPK14 Q16539 2/20 0.42
MAPT P10636 4/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
CASP3 P42574 1/20 0.40
TRPV1 Q8NER1 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
GABRG2 P18507 3/20 0.39
GABRB3 P28472 3/20 0.39
GABRA5 P31644 3/20 0.39
GABRA2 P47869 2/20 0.39
GABRB2 P47870 2/20 0.39
ALDH1A1 P00352 3/20 0.39
TDP1 Q9NUW8 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.38
CDC7 O00311 1/20 0.38
DBF4 Q9UBU7 1/20 0.38
GABRP O00591 1/20 0.38
GABRD O14764 1/20 0.38

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
SCHEMBL18070225 0.90 UGCG (0.47) MAPK14MAPTMEN1KMT2ACASP3
SCHEMBL1143122 0.83 KDM4E (0.46) MAPTMEN1KMT2AALDH1A1TDP1
SCHEMBL4117558 0.81 ALDH1A1 (0.51) TSHRMAPTMEN1KMT2AGABRG2
SCHEMBL27844683 0.80 KDM4E (0.40) UGCGHPGDKDM4E
SCHEMBL1202228 0.77 KDM4E (0.57) MAPTKMT2AALDH1A1CYP1A2CYP2D6
SCHEMBL14899552 0.75 KDM4E (0.49) MAPTKMT2AALDH1A1CYP1A2CYP2D6
SCHEMBL10515648 0.75 KDM4E (0.44) MAPTGABRG2GABRB3GABRA5ALDH1A1
SCHEMBL10517138 0.73 MAPT (0.43) MAPTMEN1KMT2ASMN1; SMN2CYP1A2
SCHEMBL1009901 0.72 MAOA (0.50) MAPTALDH1A1GAAKDM4E
SCHEMBL15101131 0.70 CYP11B1 (0.42) TSHRMAPK14MAPTMEN1KMT2A

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 TSHR 3834/4885MAPK14 2470/4885MAPT 4527/4885

“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.