SCHEMBL28240233

SCHEMBL28240233

CCC1(C)C(=O)CCC(=O)C1=O

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32
CYP2C19 P33261 1/20 0.32
TSHR P16473 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL15656161 0.83 LMNA (0.39) KDM4ELMNACYP2C19TSHRNPSR1
SCHEMBL15657556 0.73 KDM4E (0.36) KDM4ELMNACYP2C19TSHRNPSR1
SCHEMBL28240134 0.70
SCHEMBL28863286 0.67
SCHEMBL15659061 0.67 TSHR (0.41) KDM4ELMNACYP2C19TSHRNPSR1
SCHEMBL15658755 0.64 LMNA (0.43) KDM4ELMNACYP2C19TSHRNPSR1
SCHEMBL15660004 0.64 LMNA (0.35) KDM4ELMNACYP2C19TSHRNPSR1
SCHEMBL15657479 0.64 TSHR (0.39) KDM4ELMNACYP2C19TSHRNPSR1
SCHEMBL28240172 0.64 KDM4E (0.36) KDM4ELMNACYP2C19TSHRNPSR1
SCHEMBL3677973 0.63 LMNA (0.38) KDM4ELMNACYP2C19TSHRNPSR1

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
CN-105754099-B Composition and polymer 旭化成株式会社 2018-09-18 CN disclosed