SCHEMBL2816699

SCHEMBL2816699

COc1ccc(C(=O)Nc2ccc(C(C)(C)CNC(=O)c3nn(C)c4ccccc34)c(Cl)c2)cc1OC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CPT1A P50416 4/20 0.45
CPT1B Q92523 2/20 0.45
CPT2 P23786 1/20 0.45
MAPT P10636 5/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
LMNA P02545 2/20 0.44
RAB9A P51151 2/20 0.43
NPC1 O15118 1/20 0.43
NQO2 P16083 1/20 0.43
CASP3 P42574 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
POLB P06746 4/20 0.42
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
PDE4D Q08499 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
KDM4E B2RXH2 3/20 0.42
CACNA1B Q00975 1/20 0.42

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
SCHEMBL2813694 0.94 CPT1A (0.45) CPT1ACPT1BCPT2MAPTSMN1; SMN2
SCHEMBL2818047 0.91 LCK (0.45) CPT1AMAPTSMN1; SMN2LMNARAB9A
SCHEMBL2816601 0.86 POLB (0.46) CPT1AMAPTSMN1; SMN2LMNARAB9A
SCHEMBL2818030 0.83 NTRK1 (0.52) MAPTSMN1; SMN2LMNARAB9ANPC1
SCHEMBL2815607 0.80 POLB (0.54) MAPTSMN1; SMN2RAB9ANPC1NQO2
SCHEMBL2815569 0.78 HDAC3 (0.46) POLBALDH1A1KDM4E
SCHEMBL27775769 0.78 ROCK1 (0.47) CPT1ACPT1BCPT2MAPTSMN1; SMN2
SCHEMBL2818031 0.77 ROCK1 (0.46) CPT1ACPT1BCPT2MAPTSMN1; SMN2
SCHEMBL4441630 0.76 CPT1A (0.47) CPT1ACPT1BCPT2MAPTSMN1; SMN2
SCHEMBL2815321 0.75 KDM4E (0.43) MAPTRAB9APOLBALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100249123-A1 NOVEL BENZAMIDE DERIVATIVES AS MODULATORS OF THE FOLLICLE STIMULATING HORMONE ADDEX PHARMA SA (CH) 2010-09-30 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-20100249123-A1 NOVEL BENZAMIDE DERIVATIVES AS MODULATORS OF THE FOLLICLE STIMULATING HORMONE FSHR, GNRHR, SHBG CPT1A 4075/4885CPT1B 3940/4885CPT2 4365/4885

“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.