SCHEMBL7040570

SCHEMBL7040570

C=CCC(CCCC)SP(S)SC(CC=C)CCCC

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.32
ALDH1A1 P00352 1/20 0.32
DNM1 Q05193 2/20 0.31

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
SCHEMBL7075538 0.89 TSHR (0.32) TSHRALDH1A1DNM1
SCHEMBL7075066 0.85 TSHR (0.34) TSHRALDH1A1DNM1
SCHEMBL7035811 0.79
SCHEMBL757054 0.78 TSHR (0.39) TSHRALDH1A1DNM1
SCHEMBL5165999 0.78 TSHR (0.39) TSHRALDH1A1DNM1
SCHEMBL7060667 0.75
SCHEMBL6836259 0.75 TSHR (0.36) TSHRALDH1A1DNM1
SCHEMBL7027674 0.71 TSHR (0.32) TSHRALDH1A1
SCHEMBL7075028 0.71 ALDH1A1 (0.30) TSHRALDH1A1
SCHEMBL8946847 0.71 TSHR (0.43) TSHRALDH1A1DNM1

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-20040204325-A1 Transmission fluid compositions for automobiles NIPPON OIL CORPORATION 2004-10-14 US disclosed
US-20040192562-A1 Lubricating oil composition NIPPON OIL CORPORATION 2004-09-30 US disclosed