SCHEMBL4669575

SCHEMBL4669575

Cc1[nH]c2c(F)ccc(C)c2c1CCNC(=O)/C=C/c1cncc2ccccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
MAPT P10636 4/20 0.38
RAB9A P51151 3/20 0.38
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
HPGD P15428 2/20 0.38
HDAC4 P56524 3/20 0.35
MEF2D Q14814 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
GAA P10253 1/20 0.35
LMNA P02545 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
HDAC3 O15379 3/20 0.35
HDAC1 Q13547 3/20 0.35
HDAC7 Q8WUI4 2/20 0.35
HDAC2 Q92769 2/20 0.35
HDAC10 Q969S8 2/20 0.35
HDAC11 Q96DB2 2/20 0.35
HDAC8 Q9BY41 2/20 0.35

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
SCHEMBL4752217 1.00 MEN1 (0.43) MEN1KMT2AMAPTRAB9AKDM4E
SCHEMBL4669261 0.89 ALDH1A1 (0.48) MEN1KMT2AMAPTRAB9AKDM4E
SCHEMBL4017528 0.84 MEN1 (0.49) MEN1KMT2AMAPTRAB9AKDM4E
SCHEMBL4017359 0.84 MEN1 (0.49) MEN1KMT2AMAPTRAB9AKDM4E
SCHEMBL13982583 0.82 MEN1 (0.48) MEN1KMT2AMAPTRAB9AKDM4E
SCHEMBL4017825 0.82 MMP1 (0.50) MEN1KMT2AMAPTRAB9AALDH1A1
SCHEMBL4668517 0.82 MEN1 (0.43) MEN1KMT2AMAPTHDAC4MEF2D
SCHEMBL13982460 0.82 MEN1 (0.47) MEN1KMT2AMAPTRAB9AKDM4E
SCHEMBL4017822 0.82 GAA (0.55) MEN1KMT2AMAPTRAB9AKDM4E
SCHEMBL4755393 0.82 MEN1 (0.43) MEN1KMT2AMAPTHDAC4MEF2D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008152097-A1 CINNAMIC ACID DERIVATIVES AS MODULATORS OF THE EP2 RECEPTOR BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-12-18 WO claimed
EP-2003118-A1 Cinnamic acid derivatives as modulators of EP2 receptors Bayer Schering Pharma Aktiengesellschaft (DE) 2008-12-17 EP claimed
WO-2008152097-A1 CINNAMIC ACID DERIVATIVES AS MODULATORS OF THE EP2 RECEPTOR BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-12-18 WO disclosed
WO-2008152097-A1 CINNAMIC ACID DERIVATIVES AS MODULATORS OF THE EP2 RECEPTOR BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-12-18 WO disclosed
EP-2003118-A1 Cinnamic acid derivatives as modulators of EP2 receptors Bayer Schering Pharma Aktiengesellschaft (DE) 2008-12-17 EP disclosed