SCHEMBL6052256

SCHEMBL6052256

Cc1ccc(-n2ncc(C(=O)O)c2C)cc1

nearest known ligand 0.78

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.61
RAB9A P51151 7/20 0.61
NPC1 O15118 5/20 0.61
SLC9A1 P19634 1/20 0.52
SLC9A2 Q9UBY0 1/20 0.52
PTGS2 P35354 3/20 0.51
ALDH1A1 P00352 1/20 0.51
NR4A3 Q92570 1/20 0.50
NOTUM Q6P988 1/20 0.50
HPGD P15428 1/20 0.50
PKM P14618 1/20 0.50
HSD11B1 P28845 1/20 0.50
MAPT P10636 1/20 0.49
NFKB1 P19838 1/20 0.49
NFKB2 Q00653 1/20 0.49
RELA Q04206 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49

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
SCHEMBL27692438 0.88 HSD11B1 (0.62) MAPK1RAB9ANPC1SLC9A1SLC9A2
SCHEMBL27405 0.88 MAPK1 (0.78) MAPK1RAB9ANPC1SLC9A1SLC9A2
SCHEMBL13505849 0.87 MAPK1 (0.58) MAPK1RAB9ANPC1SLC9A1SLC9A2
SCHEMBL2397695 0.87 MAPK1 (0.58) MAPK1RAB9ANPC1SLC9A1SLC9A2
SCHEMBL1074233 0.87 MAPK1 (0.58) MAPK1RAB9ANPC1SLC9A1SLC9A2
SCHEMBL6052319 0.87 MAPK1 (0.58) MAPK1RAB9ANPC1SLC9A1SLC9A2
SCHEMBL1420155 0.87 KMT2A (0.61) MAPK1RAB9ANPC1SLC9A1SLC9A2
SCHEMBL15168308 0.85 RAB9A (0.56) MAPK1RAB9ANPC1SLC9A1SLC9A2
SCHEMBL6319617 0.85 MAPK1 (0.59) MAPK1RAB9ANPC1SLC9A1SLC9A2
SCHEMBL15168370 0.84 RAB9A (0.64) MAPK1RAB9ANPC1SLC9A1SLC9A2

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11078197-B2 5-membered and bicyclic heterocyclic amides as inhibitors of rock BRISTOL-MYERS SQUIBB COMPANY (US) 2021-08-03 US disclosed
EP-2837627-B1 AMIDOPYRIDINE DERIVATIVE, AND USE THEREOF MITSUBISHI TANABE PHARMA CORP (JP) 2017-01-18 EP disclosed
US-9527859-B2 Amidopyridine derivative and use thereof MITSUBISHI TANABE PHARMA CORPORATION (JP) 2016-12-27 US disclosed
US-9527859-B2 Amidopyridine derivative and use thereof MITSUBISHI TANABE PHARMA CORPORATION (JP) 2016-12-27 US disclosed
US-9527859-B2 Amidopyridine derivative and use thereof MITSUBISHI TANABE PHARMA CORPORATION (JP) 2016-12-27 US disclosed
US-9150555-B2 Amide derivative and use thereof MITSUBISHI TANABE PHARMA CORPORATION (JP) 2015-10-06 US disclosed
US-9150555-B2 Amide derivative and use thereof MITSUBISHI TANABE PHARMA CORPORATION (JP) 2015-10-06 US disclosed
US-9150555-B2 Amide derivative and use thereof MITSUBISHI TANABE PHARMA CORPORATION (JP) 2015-10-06 US disclosed
US-20150065715-A1 AMIDOPYRIDINE DERIVATIVE AND USE THEREOF MITSUBISHI TANABE PHARMA CORPORATION (JP) 2015-03-05 US disclosed
US-20150065715-A1 AMIDOPYRIDINE DERIVATIVE AND USE THEREOF MITSUBISHI TANABE PHARMA CORPORATION (JP) 2015-03-05 US disclosed
EP-2837627-A1 AMIDOPYRIDINE DERIVATIVE, AND USE THEREOF Mitsubishi Tanabe Pharma Corporation (JP) 2015-02-18 EP disclosed
EP-2657230-A1 AMIDE DERIVATIVE AND USE THEREOF Mitsubishi Tanabe Pharma Corporation (JP) 2013-10-30 EP disclosed
US-20130211075-A1 AMIDE DERIVATIVE AND USE THEREOF MITSUBISHI TANABE PHARMA CORPORATION (JP) 2013-08-15 US disclosed
US-20130211075-A1 AMIDE DERIVATIVE AND USE THEREOF MITSUBISHI TANABE PHARMA CORPORATION (JP) 2013-08-15 US disclosed
US-20130211075-A1 AMIDE DERIVATIVE AND USE THEREOF MITSUBISHI TANABE PHARMA CORPORATION (JP) 2013-08-15 US disclosed
EP-2297112-B1 PYRAZOLE COMPOUNDS AS CCR1 ANTAGONISTS BOEHRINGER INGELHEIM INT (DE) 2013-04-03 EP disclosed
US-8293917-B2 Pyrazole compounds as CCR1 antagonists BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-10-23 US disclosed
US-7015218-B1 Amide compounds and medicinal use thereof MITSUBISHI PHARMA CORPORATION (JP) 2006-03-21 US disclosed
EP-1176140-B1 AMIDE COMPOUNDS AND MEDICINAL USE THEREOF MITSUBISHI PHARMA CORP (JP) 2004-12-29 EP disclosed
EP-1176140-A1 AMIDE COMPOUNDS AND MEDICINAL USE THEREOF Mitsubishi Pharma Corporation (JP) 2002-01-30 EP 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 (3 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-20130211075-A1 AMIDE DERIVATIVE AND USE THEREOF IL2, IL4, IL5 MAPK1 764/4885RAB9A 1528/4885NPC1 1134/4885
US-11078197-B2 5-membered and bicyclic heterocyclic amides as inhibitors of rock MYLK, ROCK1, ROCK2 MAPK1 183/4885RAB9A 464/4885NPC1 4344/4885
US-20150065715-A1 AMIDOPYRIDINE DERIVATIVE AND USE THEREOF IL5, IL2, IL4 MAPK1 291/4885RAB9A 1758/4885NPC1 3284/4885

“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.