SCHEMBL319610

SCHEMBL319610

O=C(O)N[C@H]1CCCCNC1=O

nearest known ligand 0.68

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 13/20 0.68
RAB9A P51151 2/20 0.61
ALDH1A1 P00352 2/20 0.60
NPC1 O15118 1/20 0.57
KDM4E B2RXH2 1/20 0.55

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
SCHEMBL3241217 1.00 CCR2 (0.68) CCR2RAB9AALDH1A1NPC1KDM4E
SCHEMBL3487757 1.00 CCR2 (0.68) CCR2RAB9AALDH1A1NPC1KDM4E
SCHEMBL7238858 0.98 CCR2 (0.71) CCR2RAB9AALDH1A1NPC1KDM4E
SCHEMBL7238979 0.94 CCR2 (0.60) CCR2RAB9AALDH1A1NPC1KDM4E
SCHEMBL20581684 0.94 CCR2 (0.60) CCR2RAB9AALDH1A1NPC1KDM4E
SCHEMBL320179 0.94 CCR2 (0.60) CCR2RAB9AALDH1A1NPC1KDM4E
SCHEMBL3936733 0.86 CCR2 (0.50) CCR2RAB9AALDH1A1NPC1KDM4E
SCHEMBL14778920 0.86 CCR2 (0.50) CCR2RAB9AALDH1A1NPC1KDM4E
SCHEMBL7383773 0.86 CCR2 (0.50) CCR2RAB9AALDH1A1NPC1KDM4E
SCHEMBL6555302 0.86 CCR2 (0.64) CCR2RAB9AALDH1A1NPC1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230172886-A1 (S)-2-AMINO-6-((3-AMINOPROPYL)AMINO)HEXANOIC ACID (APL) FOR USE IN THE TREATMENT OF NON-ALCOHOLIC STEATOHEPATITIS (NASH), LIVER INFLAMMATION, HEPATOCELLULAR BALLOONING, LIVER FIBROSIS AND STEATOSIS TEMPLE UNIVERSITY - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION 2023-06-08 US disclosed
US-11596615-B2 Compositions and methods for treatment of insulin resistance Temple University—Of the Commonwealth System of Higher Education (US) 2023-03-07 US disclosed
US-20210052532-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF INSULIN RESISTANCE TEMPLE UNIVERSITY - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2021-02-25 US disclosed
US-20210046030-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF INSULIN RESISTANCE TEMPLE UNIVERSITY - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION 2021-02-18 US disclosed
EP-3761984-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF INSULIN RESISTANCE Temple University - Of The Commonwealth System of Higher Education (US) 2021-01-13 EP disclosed
US-10729670-B2 Compositions and methods for treatment of insulin resistance Temple University—Of The Commonwealth Systems Of Higher Education (US) 2020-08-04 US disclosed
WO-2019173640-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF INSULIN RESISTANCE TEMPLE UNIVERSITY - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2019-09-12 WO disclosed
EP-3509575-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF INSULIN RESISTANCE Temple University Of The Commonwealth System Of Higher Education (US) 2019-07-17 EP disclosed
US-20190192462-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF INSULIN RESISTANCE TEMPLE UNIVERSITY - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION 2019-06-27 US disclosed
WO-2018049019-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF INSULIN RESISTANCE TEMPLE UNIVERSITY - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2018-03-15 WO disclosed
EP-2585447-A2 COMPOUNDS AND METHODS FOR THE TREATMENT OR PREVENTION OF FLAVIVIRUS INFECTIONS Vertex Pharmaceuticals Incorporated (US) 2013-05-01 EP disclosed
WO-2012006055-A2 COMPOUNDS AND METHODS FOR THE TREATMENT OR PREVENTION OF FLAVIVIRUS INFECTIONS VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-01-12 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 (6 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-20210052532-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF INSULIN RESISTANCE GPR119, FABP4, SLC2A3 CCR2 2488/4885RAB9A 2047/4885ALDH1A1 723/4885
US-11596615-B2 Compositions and methods for treatment of insulin resistance GPR119, INSR, IAPP CCR2 3701/4885RAB9A 3235/4885ALDH1A1 2926/4885
US-10729670-B2 Compositions and methods for treatment of insulin resistance GPR119, INSR, IAPP CCR2 3701/4885RAB9A 3235/4885ALDH1A1 2926/4885
US-20190192462-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF INSULIN RESISTANCE GPR119, INSR, IAPP CCR2 3701/4885RAB9A 3235/4885ALDH1A1 2926/4885
US-20210046030-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF INSULIN RESISTANCE GPR119, INSR, IAPP CCR2 3701/4885RAB9A 3235/4885ALDH1A1 2926/4885
US-20230172886-A1 (S)-2-AMINO-6-((3-AMINOPROPYL)AMINO)HEXANOIC ACID (APL) FOR USE IN THE TREATMENT OF NON-ALCOHOLIC STEATOHEPATITIS (NASH), LIVER INFLAMMATION, HEPATOCELLULAR BALLOONING, LIVER FIBROSIS AND STEATOSIS FABP1, AADAT, FABP6 CCR2 1378/4885RAB9A 3637/4885ALDH1A1 1195/4885

“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.