SCHEMBL9621802

SCHEMBL9621802

O=C1CCCCC(C(=O)c2cc(C(=O)C3CCCCC(=O)N3)c(C(=O)C3CCCCC(=O)N3)c(C(=O)C3CCCCC(=O)N3)c2)N1

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.34
MCL1 Q07820 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.31
HDAC3 O15379 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC10 Q969S8 1/20 0.31
HDAC11 Q96DB2 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
GAA P10253 1/20 0.30
MME P08473 4/20 0.30
ACE P12821 4/20 0.30
ECE1 P42892 1/20 0.30

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
SCHEMBL7721046 0.88 ABL1 (0.38) ABL1MCL1SMN1; SMN2HDAC3HDAC1
SCHEMBL11594493 0.84 MCL1 (0.35) ABL1MCL1SMN1; SMN2HDAC3HDAC1
SCHEMBL993051 0.81 MCL1 (0.45) ABL1MCL1SMN1; SMN2GAAMME
SCHEMBL9068188 0.81 ABL1 (0.34) ABL1MCL1SMN1; SMN2HDAC3HDAC1
SCHEMBL1933595 0.80 MCL1 (0.44) ABL1MCL1SMN1; SMN2GAAMME
SCHEMBL10531994 0.80 MCL1 (0.44) ABL1MCL1SMN1; SMN2GAAMME
SCHEMBL9005424 0.79 LMNA (0.37) ABL1MCL1SMN1; SMN2HDAC3HDAC1
SCHEMBL9812944 0.79 ABL1 (0.40) ABL1SMN1; SMN2HDAC3HDAC1HDAC2
SCHEMBL991131 0.79 MCL1 (0.44) ABL1MCL1SMN1; SMN2MMEACE
SCHEMBL31032494 0.78 MCL1 (0.42) MCL1SMN1; SMN2HDAC3HDAC1HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0202419-B1 LACTAM-BLOCK COPOLYMERS AlliedSignal Inc. (US) 1992-02-12 EP disclosed
US-4843127-A POLYCARBOXYLIC ACID WITH POLYETHER OR POLYSULFIDE ALLIED-SIGNAL INC. (US) 1989-06-27 US disclosed
EP-0202419-A2 Lactam-block copolymers AlliedSignal Inc. (US) 1986-11-26 EP disclosed
US-4501861-A BLEND OF POLYCAPROLACTAM AND BLOCK POLYMER MONSANTO COMPANY (US) 1985-02-26 US disclosed
US-4346200-A Thermoplastic polyamide compositions MONSANTO COMPANY (US) 1982-08-24 US disclosed
US-4223112-A FIBERS, FOAMS, MOLDING MATERIALS MONSANTO COMPANY (US) 1980-09-16 US disclosed
US-RE30371-E POLYESTERAMIDES FROM ACYLLACTAMS AND ALCOHOLS, METAL ANIONIC CATALYSTS MONSANTO COMPANY (US) 1980-08-12 US disclosed
US-4034015-A LACTAM-POLYOL-POLYACYL LACTAM OR LACTAM-POLYOL-ACYL POLYLACTAM, BLOCK POLYMERS MONSANTO COMPANY (US) 1977-07-05 US disclosed
US-4031164-A LACTAM, POLYOL, POLYACYL LACTAM, CATALYST MONSANTO COMPANY (US) 1977-06-21 US disclosed
US-3965075-A POLYAMIDEESTERS FROM N-ACYLLACTAMS AND ALCOHOLS; TERT-AMINE OR ORGANOMETALLIC CATALYST MONSANTO COMPANY 1976-06-22 US disclosed