SCHEMBL2383875

SCHEMBL2383875

C[C@H](N)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1cc2ccccc2oc1=O

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ MMP8 P22894 1/20 0.44
▸ FCER2 P06734 3/20 0.44
▸ MAOB P27338 3/20 0.43
▸ ADAM17 P78536 1/20 0.43
▸ OPRD1 P41143 5/20 0.42
▸ OPRM1 P35372 4/20 0.42
▸ OPRK1 P41145 1/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ MAOA P21397 1/20 0.42
▸ KDR P35968 1/20 0.42
▸ MMP1 P03956 2/20 0.41
▸ TP53 P04637 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ CTRB1 P17538 1/20 0.40

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
SCHEMBL16401469 0.89 MAOB (0.49) MEN1NPC1RAB9AKMT2AMAOB
SCHEMBL5400405 0.83 MAOB (0.55) MEN1NPC1RAB9AKMT2AMAOB
SCHEMBL5400401 0.83 MAOB (0.55) MEN1NPC1RAB9AKMT2AMAOB
SCHEMBL11038734 0.83 F2RL1 (0.42) MEN1NPC1RAB9AKMT2AMMP8
SCHEMBL5614017 0.83 MAOB (0.41) MEN1NPC1RAB9AKMT2AMMP8
SCHEMBL7375030 0.81 L3MBTL1 (0.40) MEN1NPC1RAB9AKMT2AMMP8
SCHEMBL9787696 0.80 CTSS (0.58) —
SCHEMBL4264976 0.79 OPRD1 (0.55) OPRD1OPRM1OPRK1
SCHEMBL3366840 0.79 CASP1 (0.51) OPRD1KDR
SCHEMBL2157759 0.77 OPRD1 (0.52) OPRD1OPRM1OPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015084850-A1 MEMBRANE TRANSLOCATION ASSAY FOR SIRNA SIRNA THERAPEUTICS, INC. (US) 2015-06-11 — — WO disclosed
WO-2011113841-A1 EUKARYOTIC VECTOR STEINFELD ROBERT (DE) 2011-09-22 — — WO disclosed
EP-0828851-B1 TRIPEPTIDYLPEPTIDASE INHIBITORS INST NAT SANTE ETDE LA RECH ME (FR) 2005-07-20 — — EP disclosed
US-20030027743-A1 Tripeptidylpeptidase inhibitors INSERM 2003-02-06 — — US disclosed
US-6403561-B1 DISORDERS ASSOCIATED WITH THE INACTIVATION OR EXCESSIVE DEGRADATION OF CHOLECYSTOKININ; INHIBITING THE ENZYMATIC HYDROLYSIS OF CHOLECYSTOKININ 1-(2(S)-AMINOBUTYRYL)-2(S)-INDOLINECARBOXYLIC ACID INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2002-06-11 — — US disclosed
WO-1996035805-A2 TRIPEPTIDYLPEPTIDASE INHIBITORS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 1996-11-14 — — 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-20030027743-A1 Tripeptidylpeptidase inhibitors DPP4, DPP3, DPP9 MEN1 1210/4885NPC1 368/4885RAB9A 3369/4885

“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.

Send feedback