SCHEMBL11036728

SCHEMBL11036728

CC(=O)OC=C=COC(C)=O

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.37
TSHR P16473 2/20 0.37
HSD17B10 Q99714 2/20 0.30
LMNA P02545 2/20 0.30
TDP1 Q9NUW8 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
SCHEMBL26027 0.86
SCHEMBL6047446 0.84
SCHEMBL28952474 0.84
Water SCHEMBL28352114 0.84
SCHEMBL8698500 0.84
SCHEMBL11894416 0.80
SCHEMBL15387648 0.80 TSHR (0.33) TSHR
SCHEMBL527821 0.80
SCHEMBL2420521 0.79
SCHEMBL9178996 0.79

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4297506-A CIRCULATION OF SOLID INCLUSION COMPOUND COMPRISING DIACETOXYALKYLENE PRODUCT AND AN ACETATE AND HALIDE OF ALKALI METAL PHILLIPS PETROLEUM CO. (US) 1981-10-27 US claimed
WO-2019143016-A1 POSITRON EMISSION TOMOGRAPHY RADIOTRACER FOR DISEASES ASSOCIATED WITH TRANSLOCATOR PROTEIN OVEREXPRESSION, TRANSLOCATOR PROTEIN-TARGETING LIGAND FOR FLUORESCENCE IMAGING DIAGNOSIS AND PHOTODYNAMIC THERAPY, AND PREPARATION METHOD THEREFOR 서울대학교산학협력단 2019-07-25 WO disclosed
US-4544767-A HYDROGENATION CATALYST PHILLIPS PETROLEUM COMPANY (US) 1985-10-01 US disclosed
US-4306100-A Process for production of alkenediols STANDARD OIL COMPANY (INDIANA) (US) 1981-12-15 US disclosed
US-4297506-A CIRCULATION OF SOLID INCLUSION COMPOUND COMPRISING DIACETOXYALKYLENE PRODUCT AND AN ACETATE AND HALIDE OF ALKALI METAL PHILLIPS PETROLEUM CO. (US) 1981-10-27 US disclosed
US-4164616-A FROM THE CONJUGATED DIENE PHILLIPS PETROLEUM COMPANY (US) 1979-08-14 US disclosed