SCHEMBL15560740

SCHEMBL15560740

CCC(=O)Oc1cccc(C(C)C)c1-c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.41
ACLY P53396 1/20 0.40
KCNK3 O14649 1/20 0.40
KCNK9 Q9NPC2 1/20 0.40
ALOX15 P16050 1/20 0.39
KMT2A Q03164 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
RECQL P46063 1/20 0.38
USP2 O75604 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LPAR1 Q92633 1/20 0.38
NLRP3 Q96P20 1/20 0.38
LMNA P02545 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL9706054 0.86 KCNK3 (0.43) KCNK3KCNK9KMT2ALPAR1LMNA
SCHEMBL43475 0.82 ELANE (0.49) ELANEALOX15KMT2AKDM4EMEN1
SCHEMBL28422371 0.82 PPARG (0.44) ELANEACLYKMT2AKDM4EMEN1
SCHEMBL15548665 0.78 SCN5A (0.46) ALOX15NLRP3
SCHEMBL29484682 0.78 HIF1A (0.52) ALOX15NLRP3LMNA
SCHEMBL16330807 0.76 SCN5A (0.52)
SCHEMBL30791332 0.76 KCNK3 (0.47) KCNK3KCNK9KMT2AKDM4EMEN1
SCHEMBL28822603 0.75 KMT2A (0.41) ELANEACLYALOX15KMT2AKDM4E
SCHEMBL28397404 0.75 FFAR1 (0.40) KMT2ALPAR1LMNA
SCHEMBL8435546 0.75 ALOX15 (0.55) ELANEACLYALOX15KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014016766-A1 GUANIDINE DERIVATIVES AS TRPC MODULATORS GLENMARK PHARMACEUTICALS S.A. (CH) 2014-01-30 WO disclosed