SCHEMBL2838982

SCHEMBL2838982

O=C(O)CC(Oc1cccc(NC(=O)c2ccc(Nc3ncc[nH]3)cc2)c1)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.49
ITGB3 P05106 2/20 0.47
ITGAV P06756 2/20 0.47
MAPT P10636 2/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
LMNA P02545 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NPC1 O15118 3/20 0.42
RAB9A P51151 2/20 0.42
NLRP3 Q96P20 1/20 0.42
TRPV1 Q8NER1 1/20 0.41
PKM P14618 1/20 0.41
HTT P42858 1/20 0.41
KDR P35968 1/20 0.40
NAMPT P43490 1/20 0.40
GRM4 Q14833 1/20 0.40
EGFR P00533 1/20 0.40
AURKB Q96GD4 1/20 0.40
INCENP Q9NQS7 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
SCHEMBL2836419 0.93 MAPK1 (0.49) MAPK1ITGB3ITGAVMAPTMEN1
SCHEMBL2842271 0.92 ITGB3 (0.45) MAPK1ITGB3ITGAVKMT2ASMN1; SMN2
SCHEMBL2833521 0.92 ITGB3 (0.42) MAPK1ITGB3ITGAVMAPTMEN1
SCHEMBL2839497 0.88 ITGB3 (0.48) MAPK1ITGB3ITGAVMEN1KMT2A
SCHEMBL2837319 0.87 MAPT (0.42) ITGB3ITGAVMAPTMEN1KMT2A
SCHEMBL2834780 0.85 TSHR (0.46) MAPK1ITGB3ITGAVKMT2ASMN1; SMN2
SCHEMBL2836433 0.85 MAPK1 (0.51) MAPK1ITGB3ITGAVMAPTMEN1
SCHEMBL2832143 0.84 ITGB3 (0.45) MAPK1ITGB3ITGAVKMT2ALMNA
SCHEMBL7101588 0.83 RAB9A (0.40) MAPTMEN1KMT2ANPC1RAB9A
SCHEMBL2841528 0.83 ITGB3 (0.48) MAPK1ITGB3ITGAVMAPTMEN1

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-20030144311-A1 Propanoic acid derivatives as intergrin receptor antagonists PHARMACIA ITALIA S.P.A. (IT) 2003-07-31 US claimed
EP-1282602-A1 PROPANOIC ACID DERIVATIVES AS INTEGRIN RECEPTOR ANTAGONISTS Pharmacia Italia S.p.A. (IT) 2003-02-12 EP claimed
WO-2001087840-A1 PROPANOIC ACID DERIVATIVES AS INTEGRIN RECEPTOR ANTAGONISTS PHARMACIA ITALIA S.P.A. (IT) 2001-11-22 WO claimed
US-20180344803-A1 Methods and Compositions For the Treatment of Proteinuric Diseases THE GENERAL HOSPITAL CORPORATION 2018-12-06 US disclosed
US-20160296592-A1 Methods and Compositions for the Treatment of Proteinuric Diseases THE GENERAL HOSPITAL CORPORATION 2016-10-13 US disclosed
US-9345739-B2 Methods and compositions for the treatment of proteinuric diseases THE GENERAL HOSPITAL CORPORATION (US) 2016-05-24 US disclosed
US-20100297139-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT OF PROTEINURIC DISEASES THE GENERAL HOSPITAL CORPORATION 2010-11-25 US disclosed
US-6974828-B2 Propanoic acid derivatives as intergrin receptor antagonists PHARMACIA ITALIA S.P.A. (IT) 2005-12-13 US disclosed
EP-1282602-B1 PROPANOIC ACID DERIVATIVES AS INTEGRIN RECEPTOR ANTAGONISTS PHARMACIA ITALIA SPA (IT) 2005-09-21 EP disclosed
US-20030144311-A1 Propanoic acid derivatives as intergrin receptor antagonists PHARMACIA ITALIA S.P.A. (IT) 2003-07-31 US disclosed
EP-1282602-A1 PROPANOIC ACID DERIVATIVES AS INTEGRIN RECEPTOR ANTAGONISTS Pharmacia Italia S.p.A. (IT) 2003-02-12 EP disclosed
WO-2001087840-A1 PROPANOIC ACID DERIVATIVES AS INTEGRIN RECEPTOR ANTAGONISTS PHARMACIA ITALIA S.P.A. (IT) 2001-11-22 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 (4 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-20160296592-A1 Methods and Compositions for the Treatment of Proteinuric Diseases ITGB3, PLAUR, PROC MAPK1 4243/4885ITGB3 1/4885ITGAV 16/4885
US-20180344803-A1 Methods and Compositions For the Treatment of Proteinuric Diseases ITGB3, PLAUR, PROC MAPK1 4243/4885ITGB3 1/4885ITGAV 16/4885
US-20100297139-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT OF PROTEINURIC DISEASES ITGB3, PLAUR, PROC MAPK1 4243/4885ITGB3 1/4885ITGAV 16/4885
US-20030144311-A1 Propanoic acid derivatives as intergrin receptor antagonists ITGB3, HCAR3, ADRB3 MAPK1 1663/4885ITGB3 1/4885ITGAV 47/4885

“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.