SCHEMBL2349758

SCHEMBL2349758

O=C(COCc1ccccc1)Nc1ccc(NC(=O)COCc2ccccc2)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 1/20 0.70
▸ PTPRC P08575 1/20 0.68
▸ PTPN1 P18031 1/20 0.68
▸ RAB9A P51151 4/20 0.67
▸ ALDH1A1 P00352 4/20 0.67
▸ SMN1; SMN2 Q16637 3/20 0.67
▸ NPC1 O15118 1/20 0.61
▸ LTA4H P09960 1/20 0.58
▸ CSNK1D P48730 1/20 0.56
▸ ADORA3 P0DMS8 1/20 0.56
▸ ADORA2A P29274 1/20 0.56
▸ ADORA1 P30542 1/20 0.56
▸ CETP P11597 1/20 0.55
▸ EPHX2 P34913 1/20 0.55
▸ MAPT P10636 3/20 0.54
▸ HTT P42858 2/20 0.54
▸ HPGD P15428 1/20 0.54
▸ ALOX12 P18054 1/20 0.54
▸ MAPK1 P28482 1/20 0.54
▸ GAA P10253 1/20 0.54

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
SCHEMBL839348 0.96 NAMPT (0.66) NAMPTPTPRCPTPN1RAB9AALDH1A1
SCHEMBL1931512 0.95 NAMPT (0.65) NAMPTPTPRCPTPN1RAB9AALDH1A1
SCHEMBL2003113 0.92 NAMPT (0.62) NAMPTPTPRCPTPN1RAB9AALDH1A1
SCHEMBL415057 0.92 NAMPT (0.62) NAMPTPTPRCPTPN1RAB9AALDH1A1
SCHEMBL25547335 0.92 NAMPT (0.62) NAMPTPTPRCPTPN1RAB9AALDH1A1
SCHEMBL19932361 0.92 NAMPT (0.62) NAMPTPTPRCPTPN1RAB9AALDH1A1
SCHEMBL2939045 0.89 RAB9A (0.60) NAMPTPTPRCPTPN1RAB9AALDH1A1
SCHEMBL8864260 0.89 SMN1; SMN2 (0.69) NAMPTPTPRCPTPN1RAB9AALDH1A1
SCHEMBL19921018 0.89 NAMPT (0.60) NAMPTPTPRCPTPN1RAB9AALDH1A1
SCHEMBL12545622 0.88 RAB9A (0.67) NAMPTPTPRCPTPN1RAB9AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110313057-A1 DIFUNCTIONALIZED AROMATIC COMPOUNDS AND POLYMERS THEREFROM BEZWADA BIOMEDICAL, LLC (US) 2011-12-22 — — US disclosed
US-20110313057-A1 DIFUNCTIONALIZED AROMATIC COMPOUNDS AND POLYMERS THEREFROM BEZWADA BIOMEDICAL, LLC (US) 2011-12-22 — — US disclosed
US-8007526-B2 Difunctionalized aromatic compounds and polymers therefrom BEZWADA BIOMEDICAL, LLC (US) 2011-08-30 — — US disclosed
US-8007526-B2 Difunctionalized aromatic compounds and polymers therefrom BEZWADA BIOMEDICAL, LLC (US) 2011-08-30 — — US disclosed
US-8007526-B2 Difunctionalized aromatic compounds and polymers therefrom BEZWADA BIOMEDICAL, LLC (US) 2011-08-30 — — US disclosed
US-20070129787-A1 DIFUNCTIONALIZED AROMATIC COMPOUNDS AND POLYMERS THEREFROM BEZWADA BIOMEDICAL, LLC (US) 2007-06-07 — — US disclosed
US-20070129787-A1 DIFUNCTIONALIZED AROMATIC COMPOUNDS AND POLYMERS THEREFROM BEZWADA BIOMEDICAL, LLC (US) 2007-06-07 — — US disclosed
US-20070129787-A1 DIFUNCTIONALIZED AROMATIC COMPOUNDS AND POLYMERS THEREFROM BEZWADA BIOMEDICAL, LLC (US) 2007-06-07 — — 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-20110313057-A1 DIFUNCTIONALIZED AROMATIC COMPOUNDS AND POLYMERS THEREFROM AHR, OGFR, OPRM1 NAMPT 3062/4885PTPRC 1542/4885PTPN1 1284/4885

“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.

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