SCHEMBL10419871

SCHEMBL10419871

O=C(O)CCCCC(C(=O)O)N(C(=O)OCc1ccccc1)C(=O)OCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 8/20 0.53
HTT P42858 1/20 0.48
MAPT P10636 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
TPSAB1 Q15661 2/20 0.42
TPSD1 Q9BZJ3 2/20 0.42
TPSG1 Q9NRR2 2/20 0.42
HDAC3 O15379 1/20 0.41
MAPK1 P28482 1/20 0.41
ADRA1A P35348 1/20 0.41
HDAC4 P56524 1/20 0.41
SLC6A3 Q01959 1/20 0.41
HDAC1 Q13547 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HDAC7 Q8WUI4 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC10 Q969S8 1/20 0.41
HDAC11 Q96DB2 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41

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
SCHEMBL10491537 0.91 HTT (0.47) FOLH1HTTMAPTRXFP1HDAC3
SCHEMBL1491987 0.86 EPOR (0.51) FOLH1TPSAB1TPSD1TPSG1EPOR
SCHEMBL22804052 0.86 EPOR (0.51) FOLH1TPSAB1TPSD1TPSG1EPOR
SCHEMBL3776750 0.86 EPOR (0.51) FOLH1TPSAB1TPSD1TPSG1EPOR
SCHEMBL4852056 0.85 EPOR (0.46) FOLH1TPSAB1TPSD1TPSG1MAPK1
SCHEMBL9574165 0.85 EPOR (0.46) FOLH1TPSAB1TPSD1TPSG1MAPK1
SCHEMBL10477497 0.85 EPOR (0.46) FOLH1TPSAB1TPSD1TPSG1MAPK1
SCHEMBL4837028 0.83 FOLH1 (0.50) FOLH1HTTMAPTRXFP1SMN1; SMN2
SCHEMBL3648287 0.83 FOLH1 (0.52) FOLH1HTTALDH1A1
SCHEMBL3222447 0.82 EPOR (0.52) FOLH1TPSAB1TPSD1TPSG1EPOR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4916119-A IMMUNOSTIMULANT TRIPEPTIDES RHONE-POULENC INDUSTRIES (FR) 1990-04-10 US disclosed
US-4868326-A Process for the preparation of N6 -benzyloxycarbonyl-2,6-diaminopimelamic acid in the L,L or D,D or racemic forms RHONE-POULENC SANTE (FR) 1989-09-19 US disclosed
US-4742048-A Tetrapeptides and pentapeptides, their preparation and compositions containing them RHONE-POULENC INDUSTRIES (FR) 1988-05-03 US disclosed