SCHEMBL10794218

SCHEMBL10794218

Cc1ccc(C(C)CC(C)(C)c2ccc(C)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.43
ACHE P22303 1/20 0.42
STAT3 P40763 1/20 0.39
GRIA4 P48058 3/20 0.38
CHRNA7 P36544 1/20 0.34
NPC1 O15118 1/20 0.34
MAPT P10636 1/20 0.34
RAB9A P51151 1/20 0.34
RIPK1 Q13546 1/20 0.33

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
SCHEMBL12384045 0.82 PDE2A (0.43)
SCHEMBL3151324 0.82 MAPT (0.49) GRIA4NPC1MAPTRAB9ARIPK1
SCHEMBL3480352 0.82 SHBG (0.52) TSHRMAPT
SCHEMBL19012408 0.81 ALDH1A1 (0.44) TSHRNPC1MAPTRAB9A
SCHEMBL12556821 0.78 TSHR (0.41) TSHRACHENPC1MAPTRAB9A
SCHEMBL21671652 0.78 NPC1 (0.49) GRIA4NPC1MAPTRAB9A
SCHEMBL4402678 0.78 TSHR (0.44) TSHRNPC1MAPTRAB9A
SCHEMBL4402677 0.78 TSHR (0.44) TSHRNPC1MAPTRAB9A
SCHEMBL1019329 0.78 RIPK1 (0.52) RIPK1
SCHEMBL4402682 0.78 TSHR (0.44) TSHRNPC1MAPTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0103868-B1 IMPROVED ELECTRICAL INSULATING OIL AND OIL-FILLED ELECTRICAL APPLIANCES NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1987-04-08 EP disclosed
US-4493943-A MIXTURES OF DIARYLALKANES AND AROMATIC MONO-OR DI-OLEFINS NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1985-01-15 US disclosed
EP-0103868-A2 Improved electrical insulating oil and oil-filled electrical appliances NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1984-03-28 EP disclosed