SCHEMBL12148757

SCHEMBL12148757

CNCCCC[C@@H]1NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC1=O

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ITGB3 P05106 11/20 0.55
▸ ITGAV P06756 7/20 0.55
▸ ITGB1 P05556 1/20 0.55
▸ ITGA5 P08648 1/20 0.55
▸ MC4R P32245 9/20 0.54
▸ MC5R P33032 9/20 0.54
▸ MC3R P41968 9/20 0.54
▸ MC1R Q01726 9/20 0.54
▸ ITGA2B P08514 4/20 0.53
▸ ITGB5 P18084 4/20 0.53

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
SCHEMBL22970320 1.00 ITGB3 (0.55) ITGB3ITGAVITGB1ITGA5MC4R
SCHEMBL21766911 0.94 ITGB3 (0.58) ITGB3ITGAVITGB1ITGA5MC4R
SCHEMBL19605458 0.94 ITGB3 (0.58) ITGB3ITGAVITGB1ITGA5MC4R
SCHEMBL20888358 0.94 ITGB3 (0.58) ITGB3ITGAVITGB1ITGA5MC4R
SCHEMBL21257776 0.94 ITGB3 (0.54) ITGB3ITGAVITGB1ITGA5MC4R
SCHEMBL19412647 0.94 ITGB3 (0.54) ITGB3ITGAVITGB1ITGA5MC4R
SCHEMBL15160074 0.94 ITGB3 (0.54) ITGB3ITGAVITGB1ITGA5MC4R
SCHEMBL24253221 0.92 ITGB3 (0.49) ITGB3ITGAVITGA2BITGB5
SCHEMBL19605457 0.92 ITGB3 (0.57) ITGB3ITGAVITGB1ITGA5MC4R
SCHEMBL24253307 0.92 ITGB3 (0.57) ITGB3ITGAVITGB1ITGA5MC4R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11066665-B2 Antitumor drug delivery formulation PUBLIC UNIVERSITY CORPORATION NAGOYA CITY UNIVERSITY (JP) 2021-07-20 — — US disclosed
US-20210187005-A1 PHARMACEUTICAL COMPOSITION KAWASAKI INSTITUTE OF INDUSTRIAL PROMOTION (JP) 2021-06-24 — — US disclosed
US-11020418-B2 Unit structure-type pharmaceutical composition for nucleic acid delivery NANOCARRIER CO., LTD. (JP) 2021-06-01 — — US disclosed
US-10993960-B1 Pharmaceutical composition KAWASAKI INSTITUTE OF INDUSTRIAL PROMOTION (JP) 2021-05-04 — — US disclosed
US-20180153920-A1 UNIT STRUCTURE-TYPE PHARMACEUTICAL COMPOSITION FOR NUCLEIC ACID DELIVERY NANOCARRIER CO., LTD. (JP) 2018-06-07 — — US disclosed
US-20180042955-A1 UNIT STRUCTURE-TYPE PHARMACEUTICAL COMPOSITION FOR NUCLEIC ACID DELIVERY NANO MRNA CO., LTD. (JP) 2018-02-15 — — US disclosed
US-9808480-B2 Unit structure-type pharmaceutical composition for nucleic acid delivery NANOCARRIER CO., LTD. (JP) 2017-11-07 — — US disclosed
EP-3141243-A1 PHARMACEUTICAL COMPOSITION The University of Tokyo (JP) 2017-03-15 — — EP disclosed
EP-2781536-B1 BLOCK COPOLYMER HAVING PHENYLBORONIC ACID GROUP INTRODUCED THEREIN, AND USE THEREOF UNIV TOKYO (JP) 2016-08-17 — — EP disclosed
US-9278075-B2 Particle composition and pharmaceutical composition using particle composition NANOCARRIER CO., LTD. (JP) 2016-03-08 — — US disclosed
US-20150080454-A1 UNIT STRUCTURE-TYPE PHARMACEUTICAL COMPOSITION FOR NUCLEIC ACID DELIVERY NANOCARRIER CO., LTD. (JP) 2015-03-19 — — US disclosed
US-20140017328-A1 PARTICLE COMPOSITION AND PHARMACEUTICAL COMPOSITION USING PARTICLE COMPOSITION NANOCARRIER CO., LTD. (JP) 2014-01-16 — — US disclosed
US-20110286923-A1 NOVEL CONJUGATES OF POLYMERS HAVING A THERAPEUTICALLY ACTIVE AGENT AND AN ANGIOGENESIS TARGETING MOIETY ATTACHED THERETO AND USES THEREOF IN THE TREATMENT OF ANGIOGENESIS RELATED DISEASES Fundacion de la Communidad Valenciana Centro de Investigacion principe felipe (ES) 2011-11-24 — — US disclosed
US-20070275911-A1 Targeted Drug-Formaldehyde Conjugates and Methods of Making and Using the Same THE REGENTS OF THE UNIVERSITY OF COLORADO 2007-11-29 — — US disclosed
US-20070275911-A1 Targeted Drug-Formaldehyde Conjugates and Methods of Making and Using the Same THE REGENTS OF THE UNIVERSITY OF COLORADO 2007-11-29 — — 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 (10 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-20180153920-A1 UNIT STRUCTURE-TYPE PHARMACEUTICAL COMPOSITION FOR NUCLEIC ACID DELIVERY POLRMT, SSU72, PARG ITGB3 3989/4885ITGAV 1728/4885ITGB1 3175/4885
US-11020418-B2 Unit structure-type pharmaceutical composition for nucleic acid delivery POLRMT, SSU72, CTDSP1 ITGB3 3881/4885ITGAV 1943/4885ITGB1 3109/4885
US-20140017328-A1 PARTICLE COMPOSITION AND PHARMACEUTICAL COMPOSITION USING PARTICLE COMPOSITION H1-0, H1-10, H1-2 ITGB3 1926/4885ITGAV 2025/4885ITGB1 1192/4885
US-20110286923-A1 NOVEL CONJUGATES OF POLYMERS HAVING A THERAPEUTICALLY ACTIVE AGENT AND AN ANGIOGENESIS TARGETING MOIETY ATTACHED THERETO AND USES THEREOF IN THE TREATMENT OF ANGIOGENESIS RELATED DISEASES VEGFA, FLT4, FLT1 ITGB3 105/4885ITGAV 68/4885ITGB1 171/4885
US-20210187005-A1 PHARMACEUTICAL COMPOSITION ABCB11, ABCB1, ABCG2 ITGB3 711/4885ITGAV 869/4885ITGB1 206/4885
US-10993960-B1 Pharmaceutical composition ABCB11, ABCB1, ABCG2 ITGB3 711/4885ITGAV 869/4885ITGB1 206/4885
US-20070275911-A1 Targeted Drug-Formaldehyde Conjugates and Methods of Making and Using the Same HCAR1, DHFR, FOLR1 ITGB3 1861/4885ITGAV 1395/4885ITGB1 1793/4885
US-11066665-B2 Antitumor drug delivery formulation SLC67A1, MCTS1, SLC47A1 ITGB3 3721/4885ITGAV 3110/4885ITGB1 2345/4885
US-20150080454-A1 UNIT STRUCTURE-TYPE PHARMACEUTICAL COMPOSITION FOR NUCLEIC ACID DELIVERY CTDSP1, SMC1A, SSU72 ITGB3 3321/4885ITGAV 1331/4885ITGB1 2440/4885
US-20180042955-A1 UNIT STRUCTURE-TYPE PHARMACEUTICAL COMPOSITION FOR NUCLEIC ACID DELIVERY POLRMT, SSU72, CTDSP1 ITGB3 3881/4885ITGAV 1943/4885ITGB1 3109/4885

“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