SCHEMBL4382048

SCHEMBL4382048

CC1CCC(C(C)C)[C](C(=O)OC2CCCCO2)C1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 2/20 0.32
EPHX1 P07099 2/20 0.32
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL7714296 0.81 SLC6A3 (0.30) SLC6A3EPHX1
SCHEMBL4379358 0.76 NPC1 (0.35)
SCHEMBL11291779 0.75 ALDH1A1 (0.35) EPHX1MEN1KMT2A
SCHEMBL7731793 0.70 EPHX1 (0.37) EPHX1MEN1KMT2A
SCHEMBL4815133 0.70 NPC1 (0.40) EPHX1MEN1KMT2A
SCHEMBL11931641 0.69 SLC6A3 (0.37) SLC6A3MEN1KMT2A
SCHEMBL10799911 0.69 SLC6A3 (0.37) SLC6A3MEN1KMT2A
SCHEMBL14640917 0.69 SLC6A3 (0.37) SLC6A3MEN1KMT2A
SCHEMBL4382050 0.68 EPHX1 (0.49) EPHX1
SCHEMBL12941461 0.68 MEN1 (0.33) SLC6A3MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8211984-B2 Ring-opening metathesis polymer, hydrogenated product thereof, method for preparing the same, and use thereof MITSUI CHEMICALS, INC. (JP) 2012-07-03 US disclosed
US-20090215974-A1 RING-OPENING METATHESIS POLYMER, HYDROGENATED PRODUCT THEREOF, METHOD FOR PREPARING THE SAME, AND USE THEREOF MITSUI CHEMICALS INC (JP) 2009-08-27 US disclosed
EP-2045280-A1 RING-OPENING METATHESIS POLYMERS, PRODUCTS OF HYDROGENATION THEREOF, PROCESS FOR PRODUCTION OF THE SAME AND USES THEREOF Mitsui Chemicals, Inc. (JP) 2009-04-08 EP disclosed
US-6372854-B1 POLYALKENAMERS USED AS PHOTORESISTS HAVING EXCELLENT OPTICAL ELECTRICAL PROPERTIES; HIGH RIGIDITY; HEAT RESISTANCE; ADHESION AND WEAR RESISTANCE; HYDROGENATION; ACIDOLYSIS MITSUI CHEMICALS, INC. (JP) 2002-04-16 US disclosed