SCHEMBL4359285

SCHEMBL4359285

O=C(O)C(C1CC=CCC1)C1CCC(C(C(=O)O)C2CC=CCC2)CC1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.33
ALDH1A1 P00352 4/20 0.31
KDM4E B2RXH2 3/20 0.31
TDP1 Q9NUW8 2/20 0.31
PRSS1 P07477 1/20 0.30
CTSG P08311 1/20 0.30
CTRB1 P17538 1/20 0.30
CMA1 P23946 1/20 0.30
MEN1 O00255 2/20 0.30
HTT P42858 2/20 0.30
KMT2A Q03164 2/20 0.30
MAPT P10636 1/20 0.30
ALOX15 P16050 1/20 0.30
ESR2 Q92731 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL465427 0.82 PRSS1 (0.30) PRSS1CTSGCTRB1CMA1
SCHEMBL849367 0.78 EPHX1 (0.42) ALDH1A1KDM4ETDP1MEN1KMT2A
SCHEMBL22279579 0.76 ALDH1A1 (0.31) ALDH1A1KDM4ETDP1PRSS1CTSG
SCHEMBL11686516 0.76 SLC1A2 (0.38) ALDH1A1KDM4EMEN1KMT2A
SCHEMBL9183927 0.76 ALDH1A1 (0.35) ALDH1A1KDM4ETDP1PRSS1CTSG
SCHEMBL25946833 0.76 ALDH1A1 (0.31) ALDH1A1KDM4ETDP1PRSS1CTSG
SCHEMBL28601574 0.72 CYP1A2 (0.37) ALDH1A1KDM4ETDP1
SCHEMBL9182811 0.72 KDM4E (0.40) ALDH1A1KDM4ETDP1PRSS1CTSG
SCHEMBL7225302 0.71 PRSS1 (0.32) ALDH1A1KDM4ETDP1PRSS1CTSG
SCHEMBL3087559 0.69

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-20090281275-A1 Curable resin compositions and interlayer dielectric films DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2009-11-12 US disclosed
EP-1840149-A1 CURABLE RESIN COMPOSITION AND INTERLAYER INSULATING FILM Daicel Chemical Industries, Ltd. (JP) 2007-10-03 EP disclosed