SCHEMBL16640966

SCHEMBL16640966

CCCCNC(=O)N(CC1CO1)c1ccc(Cc2ccc(N(C(=O)NCCCC)C(=O)NCCCC)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.44
LTB4R2 Q9NPC1 1/20 0.41
HPGD P15428 3/20 0.39
KMT2A Q03164 3/20 0.36
MAPT P10636 1/20 0.36
HDAC1 Q13547 2/20 0.34
HDAC6 Q9UBN7 2/20 0.34
KDM4E B2RXH2 2/20 0.34
BCHE P06276 2/20 0.33
MEN1 O00255 2/20 0.33
RAB9A P51151 1/20 0.33
THRA P10827 1/20 0.32
THRB P10828 1/20 0.32
TSHR P16473 1/20 0.32
HTT P42858 1/20 0.32
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL16640938 0.95 ALOX5 (0.45) ALOX5LTB4R2HPGDKMT2AMAPT
SCHEMBL16641015 0.90 ALOX5 (0.45) ALOX5LTB4R2HPGDKMT2AMAPT
SCHEMBL16641026 0.87 ALOX5 (0.43) ALOX5LTB4R2HPGDKMT2AMAPT
SCHEMBL16641016 0.86 ALOX5 (0.39) ALOX5LTB4R2HPGDKMT2AMAPT
SCHEMBL16640955 0.82 ALOX5 (0.39) ALOX5LTB4R2HPGDKMT2AKDM4E
SCHEMBL16641028 0.82 ALOX5 (0.43) ALOX5LTB4R2HPGDKMT2AMAPT
SCHEMBL16640925 0.80 ALOX5 (0.42) ALOX5LTB4R2HPGDKMT2AMAPT
SCHEMBL16640957 0.80 ALOX5 (0.38) ALOX5LTB4R2HPGDKMT2AMAPT
SCHEMBL16641025 0.78 ALOX5 (0.41) ALOX5LTB4R2HPGDKMT2AMAPT
SCHEMBL19901213 0.78 ALOX5 (0.35) ALOX5RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9902803-B2 Epoxy compound having alkoxy silyl group, composition comprising same, cured product, use thereof and method for preparing epoxy compound having alkoxy silyl group KOREA INSTITUTE OF INDUSTRIAL TECHNOLOGY (KR) 2018-02-27 US disclosed
US-20150105493-A1 EPOXY COMPOUND HAVING ALKOXY SILYL GROUP, COMPOSITION COMPRISING SAME, CURED PRODUCT, USE THEREOF AND METHOD FOR PREPARING EPOXY COMPOUND HAVING ALKOXY SILYL GROUP KOREA INSTITUTE OF INDUSTRIAL TECHNOLOGY (KR) 2015-04-16 US disclosed