SCHEMBL13010038

SCHEMBL13010038

CCC(C)(C)C(=O)NCCNC(=O)NC1CCC(C(=O)O)CC1

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 15/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
EPHX2 P34913 4/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL10110683 0.85 RECQL (0.39) EPHX1KDM4EALDH1A1EPHX2
SCHEMBL14114327 0.84 CCR2 (0.42) ALDH1A1
SCHEMBL10110690 0.82 EPHX1 (0.40) EPHX1KDM4EALDH1A1EPHX2
SCHEMBL12389387 0.78 RIPK1 (0.39) ALDH1A1KMT2A
SCHEMBL18909746 0.73 CCR2 (0.49) EPHX1ALDH1A1
SCHEMBL14153992 0.73 RIPK1 (0.52) EPHX1ALDH1A1KMT2A
SCHEMBL13921991 0.70 EPHX2 (0.41) EPHX1KDM4EALDH1A1EPHX2
SCHEMBL20144534 0.70 EPHX2 (0.46) EPHX1KDM4EALDH1A1EPHX2
SCHEMBL16886275 0.70 ALDH1A1 (0.50) EPHX1ALDH1A1
SCHEMBL16886889 0.70 ALDH1A1 (0.50) EPHX1ALDH1A1

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
US-20100323284-A1 PIGMENT-DISPERSED COMPOSITION, CURABLE COMPOSITION, COLOR FILTER AND PRODUCTION METHOD THEREOF FUJIFILM CORPORATION (JP) 2010-12-23 US disclosed