SCHEMBL16632653

SCHEMBL16632653

C(OCC1CO1)C1CO1.CCC(O)CCCCO

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.46
SMN1; SMN2 Q16637 1/20 0.43
TDP1 Q9NUW8 1/20 0.41
TSHR P16473 2/20 0.40
MAPK1 P28482 1/20 0.37

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
SCHEMBL16424449 0.98 ALDH1A1 (0.45) ALDH1A1SMN1; SMN2TDP1TSHRMAPK1
SCHEMBL16424381 0.98 ALDH1A1 (0.45) ALDH1A1SMN1; SMN2TDP1TSHRMAPK1
SCHEMBL16424214 0.98 ALDH1A1 (0.45) ALDH1A1SMN1; SMN2TDP1TSHRMAPK1
SCHEMBL16424568 0.95 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2TDP1TSHRMAPK1
Butane SCHEMBL28029666 0.92 ALDH1A1 (0.49) ALDH1A1SMN1; SMN2TDP1TSHRMAPK1
SCHEMBL16423838 0.89 ALDH1A1 (0.53) ALDH1A1SMN1; SMN2TDP1TSHRMAPK1
SCHEMBL16423872 0.89 ALDH1A1 (0.51) ALDH1A1SMN1; SMN2TDP1TSHR
SCHEMBL16423571 0.89 SMN1; SMN2 (0.46) ALDH1A1SMN1; SMN2TDP1TSHRMAPK1
3-Octanol SCHEMBL27695453 0.89 ALDH1A1 (0.55) ALDH1A1SMN1; SMN2TDP1TSHRMAPK1
SCHEMBL16424470 0.88 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2TDP1TSHRMAPK1

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-9441069-B2 Epoxy resin, method for producing epoxy resin, epoxy resin composition, cured product thereof, and heat-dissipating resin material DIC CORPORATION (JP) 2016-09-13 US disclosed
CN-104220477-B The manufacture method of epoxy resin, epoxy resin, composition epoxy resin, its cured article and heat radiation resin material DIC CORP. (JP) 2015-11-25 CN disclosed
US-20150104651-A1 EPOXY RESIN, METHOD FOR PRODUCING EXPOXY RESIN, EPOXY RESIN COMPOSITION, CURED PRODUCT THEREOF, AND HEAT-DISSIPATING RESIN MATERIAL DIC CORPORATION (JP) 2015-04-16 US disclosed
CN-104220477-A Epoxy resin, method for producing epoxy resin, epoxy resin composition, cured product thereof, and heat-dissipating resin material DAINIPPON INK & CHEMICALS 2014-12-17 CN disclosed