SCHEMBL31369145

SCHEMBL31369145

CC(C)(C)C(=O)/C=C(/O)C(C)(C)C.CC(C)(C)C(=O)/C=C(/O)C(C)(C)C.[Ni]

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.37
NPC1 O15118 1/20 0.37
MAPK1 P28482 2/20 0.33
RAB9A P51151 1/20 0.33
HSD17B10 Q99714 1/20 0.33
ALDH1A1 P00352 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
SCHEMBL29868552 1.00 TSHR (0.37) TSHRNPC1MAPK1RAB9AHSD17B10
SCHEMBL29754099 1.00 TSHR (0.37) TSHRNPC1MAPK1RAB9AHSD17B10
SCHEMBL29565559 1.00 TSHR (0.37) TSHRNPC1MAPK1RAB9AHSD17B10
SCHEMBL5535228 0.97 TSHR (0.38) TSHRNPC1MAPK1RAB9AHSD17B10
SCHEMBL13725736 0.97 TSHR (0.38) TSHRNPC1MAPK1RAB9AHSD17B10
SCHEMBL13725734 0.97 TSHR (0.38) TSHRNPC1MAPK1RAB9AHSD17B10
SCHEMBL31099433 0.94 TSHR (0.37) TSHRNPC1MAPK1RAB9AHSD17B10
SCHEMBL21410657 0.94 TSHR (0.37) TSHRNPC1MAPK1RAB9AHSD17B10
SCHEMBL31048535 0.94 TSHR (0.37) TSHRNPC1MAPK1RAB9AHSD17B10
SCHEMBL31663664 0.94 TSHR (0.37) TSHRNPC1MAPK1RAB9AHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250145521-A1 PROCESS FOR FORMING A COATING PILKINGTON GROUP LIMITED (GB) 2025-05-08 US claimed
US-20250268689-A1 METHOD OF MAKING NET SHAPED DENTAL DEVICES KNAPP KENNETH E (US) 2025-08-28 US disclosed
US-20250263639-A1 Cleaning Solution, Method For Cleaning Substrate, And Method For Forming Metal Containing Film SHIN-ETSU CHEMICAL CO., LTD. (JP) 2025-08-21 US disclosed
US-20250145521-A1 PROCESS FOR FORMING A COATING PILKINGTON GROUP LIMITED (GB) 2025-05-08 US disclosed
WO-2025059098-A2 PHOTOCATALYTIC CARBOXYLATION OF SUBSTRATES WITH CARBON OXIDE NEW IRIDIUM INC. (US) 2025-03-20 WO disclosed