SCHEMBL2819794

SCHEMBL2819794

COc1ccc(C(=O)Nc2ccc(C3(C(=O)N(C)C)CCCC3)cc2)cc1OC

nearest known ligand 0.72

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 9/20 0.72
KDM4E B2RXH2 4/20 0.72
NPC1 O15118 6/20 0.65
RAB9A P51151 6/20 0.65
MEN1 O00255 5/20 0.65
HDAC1 Q13547 2/20 0.58
MAPT P10636 5/20 0.56
ALDH1A1 P00352 3/20 0.56
USP2 O75604 2/20 0.56
PKM P14618 4/20 0.53
HPGD P15428 2/20 0.52
POLB P06746 2/20 0.51
GAA P10253 1/20 0.51
SMN1; SMN2 Q16637 2/20 0.50
TP53 P04637 1/20 0.50
CYP2C9 P11712 1/20 0.50
NQO2 P16083 1/20 0.50
CASP3 P42574 1/20 0.50
SENP7 Q9BQF6 1/20 0.50

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
SCHEMBL2814882 0.88 KMT2A (0.64) KMT2AKDM4ENPC1RAB9AMEN1
SCHEMBL2815432 0.87 KMT2A (0.76) KMT2AKDM4ENPC1RAB9AMEN1
SCHEMBL2817570 0.87 KMT2A (0.76) KMT2AKDM4ENPC1RAB9AMEN1
SCHEMBL2814616 0.87 KMT2A (0.76) KMT2AKDM4ENPC1RAB9AMEN1
SCHEMBL2819698 0.85 KMT2A (0.80) KMT2AKDM4ENPC1RAB9AMEN1
SCHEMBL2819535 0.83 KMT2A (1.00) KMT2AKDM4ENPC1RAB9AMEN1
SCHEMBL2815498 0.80 KMT2A (0.67) KMT2AKDM4ENPC1RAB9AMEN1
SCHEMBL2817652 0.79 KMT2A (0.69) KMT2AKDM4ENPC1RAB9AMEN1
SCHEMBL2816115 0.79 KMT2A (0.66) KMT2AKDM4ENPC1RAB9AMEN1
SCHEMBL2814692 0.79 KMT2A (0.66) KMT2AKDM4ENPC1RAB9AMEN1

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-20100249123-A1 NOVEL BENZAMIDE DERIVATIVES AS MODULATORS OF THE FOLLICLE STIMULATING HORMONE ADDEX PHARMA SA (CH) 2010-09-30 US disclosed
EP-2134676-A2 NOVEL BENZAMIDE DERIVATIVES AS MODULATORS OF THE FOLLICLE STIMULATING HORMONE Addex Pharma SA (CH) 2009-12-23 EP disclosed
WO-2008117175-A2 NOVEL BENZAMIDE DERIVATIVES AS MODULATORS OF THE FOLLICLE STIMULATING HORMONE ADDEX PHARMA SA (CH) 2008-10-02 WO 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 KMT2A 1767/4885KDM4E 1395/4885NPC1 3400/4885

“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.