SCHEMBL28635910

SCHEMBL28635910

C=CCCCC=C(C)CC(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.36
ALDH1A1 P00352 1/20 0.36
ALOX15 P16050 2/20 0.33
LSS P48449 1/20 0.32

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
SCHEMBL465310 0.76 TSHR (0.46) TSHRALDH1A1ALOX15LSS
SCHEMBL848618 0.76 TSHR (0.46) TSHRALDH1A1ALOX15LSS
SCHEMBL465309 0.76 TSHR (0.46) TSHRALDH1A1ALOX15LSS
SCHEMBL6461811 0.74 TSHR (0.39) TSHRALDH1A1ALOX15
SCHEMBL19264258 0.73
SCHEMBL4306769 0.73 ALOX15 (0.37) ALOX15
SCHEMBL4306767 0.73 ALOX15 (0.37) ALOX15
SCHEMBL847998 0.72 TSHR (0.48) TSHRALDH1A1ALOX15LSS
SCHEMBL847999 0.72 TSHR (0.48) TSHRALDH1A1ALOX15LSS
SCHEMBL43730 0.72

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
CN-113365965-A Catalytic process for the dimerization of olefins 巴斯夫欧洲公司 2021-09-07 CN disclosed