SCHEMBL7940025

SCHEMBL7940025

O=CCCCCP.O=[Ti]=O

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.47
TSHR P16473 2/20 0.42
FAAH O00519 2/20 0.37
TRPV1 Q8NER1 2/20 0.37
ALDH1A1 P00352 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
SCHEMBL6846129 0.91
SCHEMBL13573374 0.88 HIF1A (0.53) HIF1ATSHRFAAHTRPV1ALDH1A1
Water SCHEMBL8152740 0.88
SCHEMBL13546248 0.88
SCHEMBL10877941 0.86
SCHEMBL7521978 0.86
SCHEMBL317349 0.82
SCHEMBL16816939 0.74 HIF1A (0.82) HIF1ATSHRFAAHTRPV1ALDH1A1
SCHEMBL139711 0.74
SCHEMBL30678314 0.74

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
WO-2001058995-A1 THERMAL INSULATION MATERIAL WINN & COALES INTERNATIONAL LIMITED (GB) 2001-08-16 WO disclosed