SCHEMBL15768969

SCHEMBL15768969

COc1cc(CCc2ccc(Cl)cn2)ccn1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LOX P28300 1/20 0.50
LOXL2 Q9Y4K0 1/20 0.50
CNR1 P21554 1/20 0.35
FFAR1 O14842 1/20 0.34
GSK3B P49841 3/20 0.34
GSK3A P49840 2/20 0.34
SCN9A Q15858 1/20 0.34
GRM2 Q14416 1/20 0.34
NFE2L2 Q16236 1/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
PLA2G7 Q13093 1/20 0.33
RAB9A P51151 1/20 0.33
CDK2 P24941 1/20 0.33
MCHR1 Q99705 1/20 0.33
NR3C2 P08235 1/20 0.33

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
SCHEMBL15769250 0.83 LOX (0.50) LOXLOXL2FFAR1GSK3BGSK3A
SCHEMBL2963636 0.78 LOX (0.54) LOXLOXL2RAB9A
SCHEMBL2964822 0.73 LOXL2 (0.61) LOXLOXL2FFAR1PLA2G7NR3C2
SCHEMBL12885959 0.73 RAB9A (0.47) CNR1MEN1KMT2ARAB9A
SCHEMBL12093687 0.73 LOXL2 (0.65) LOXLOXL2CNR1FFAR1GSK3B
SCHEMBL2497237 0.72 LOXL2 (0.62) LOXLOXL2FFAR1GSK3BGSK3A
SCHEMBL6218599 0.72 LOXL2 (0.73) LOXLOXL2FFAR1MEN1KMT2A
SCHEMBL22336235 0.72 LOXL2 (0.68) LOXLOXL2FFAR1GSK3BGSK3A
SCHEMBL14486857 0.72 LOXL2 (0.62) LOXLOXL2FFAR1GSK3BGSK3A
SCHEMBL12093676 0.72 LOXL2 (0.62) LOXLOXL2FFAR1GSK3BGSK3A

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-20140163012-A1 PYRIDO-/AZEPINO-BENZOFURAN AND PYRIDO-/AZEPINO-BENZOTHIOPHENE MCH-1 ANTAGONISTS, METHODS OF MAKING, AND USE THEREOF ALBANY MOLECULAR RESEARCH, INC. (US) 2014-06-12 US disclosed
US-20140163012-A1 PYRIDO-/AZEPINO-BENZOFURAN AND PYRIDO-/AZEPINO-BENZOTHIOPHENE MCH-1 ANTAGONISTS, METHODS OF MAKING, AND USE THEREOF ALBANY MOLECULAR RESEARCH, INC. (US) 2014-06-12 US disclosed
US-20140163012-A1 PYRIDO-/AZEPINO-BENZOFURAN AND PYRIDO-/AZEPINO-BENZOTHIOPHENE MCH-1 ANTAGONISTS, METHODS OF MAKING, AND USE THEREOF ALBANY MOLECULAR RESEARCH, INC. (US) 2014-06-12 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-20140163012-A1 PYRIDO-/AZEPINO-BENZOFURAN AND PYRIDO-/AZEPINO-BENZOTHIOPHENE MCH-1 ANTAGONISTS, METHODS OF MAKING, AND USE THEREOF MCHR1, MCHR2, TAAR1 LOX 237/4885LOXL2 643/4885CNR1 78/4885

“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.