SCHEMBL9964896

SCHEMBL9964896

CON(C)C(=O)[C@@H]1Cc2ccccc2N1C(=O)OCc1ccccc1

nearest known ligand 0.71

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
OPRM1 P35372 3/20 0.43
OPRL1 P41146 3/20 0.43
PTGDR2 Q9Y5Y4 1/20 0.43
TMEM97 Q5BJF2 1/20 0.42
SIGMAR1 Q99720 1/20 0.42
F10 P00742 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
SCHEMBL4434465 1.00 NPC1 (0.46) NPC1RAB9AL3MBTL1OPRM1OPRL1
SCHEMBL5764293 0.84 DRD2 (0.53) NPC1RAB9AL3MBTL1
SCHEMBL24582713 0.83 NPC1 (0.54) NPC1RAB9AL3MBTL1
SCHEMBL1000224 0.83 NPC1 (0.54) NPC1RAB9AL3MBTL1
SCHEMBL4442416 0.83 OPRM1 (0.47) OPRM1OPRL1
SCHEMBL3208272 0.83 NPC1 (0.54) NPC1RAB9AL3MBTL1
SCHEMBL1150621 0.82 NPC1 (0.46) NPC1RAB9AL3MBTL1PTGDR2TMEM97
SCHEMBL31092767 0.81 OPRL1 (0.41) OPRM1OPRL1
SCHEMBL31092768 0.81 OPRL1 (0.41) OPRM1OPRL1
SCHEMBL7036798 0.81 PTPN1 (0.52) NPC1RAB9AL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120157434-A1 Antimicrobial heterocyclic compounds for treatment of bacterial infections CSO of MicuRx Pharmaceuticals, Inc. 2012-06-21 US disclosed
US-20120157434-A1 Antimicrobial heterocyclic compounds for treatment of bacterial infections CSO of MicuRx Pharmaceuticals, Inc. 2012-06-21 US disclosed
US-20100069441-A1 ANTIMICROBIAL INDOLINE COMPOUNDS FOR TREATMENT OF BACTERIAL INFECTIONS GORDEEV MIKHAIL FEDOROVICH 2010-03-18 US disclosed
US-20100069441-A1 ANTIMICROBIAL INDOLINE COMPOUNDS FOR TREATMENT OF BACTERIAL INFECTIONS GORDEEV MIKHAIL FEDOROVICH 2010-03-18 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 (2 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-20100069441-A1 ANTIMICROBIAL INDOLINE COMPOUNDS FOR TREATMENT OF BACTERIAL INFECTIONS IDO1, IDO2, INMT NPC1 1168/4885RAB9A 1349/4885L3MBTL1 3059/4885
US-20120157434-A1 Antimicrobial heterocyclic compounds for treatment of bacterial infections NISCH, NOD1, NQO1 NPC1 515/4885RAB9A 1343/4885L3MBTL1 3076/4885

“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.