SCHEMBL10451601

SCHEMBL10451601

O=CCCCCCCCCCCCCCCCCCCCCCCCCCO

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.53
TSHR P16473 3/20 0.52
FAAH O00519 2/20 0.46
TRPV1 Q8NER1 2/20 0.46
GPR84 Q9NQS5 1/20 0.39
FFAR1 O14842 1/20 0.39
FFAR4 Q5NUL3 1/20 0.39
LMNA P02545 2/20 0.38
ALDH1A1 P00352 2/20 0.38
HSD17B10 Q99714 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.33
KDM4E B2RXH2 1/20 0.32
MAPT P10636 1/20 0.31
CAMK2A Q9UQM7 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
SCHEMBL1958540 1.00 HIF1A (0.53) HIF1ATSHRFAAHTRPV1GPR84
SCHEMBL3089090 1.00 HIF1A (0.53) HIF1ATSHRFAAHTRPV1GPR84
SCHEMBL13287154 1.00 HIF1A (0.53) HIF1ATSHRFAAHTRPV1GPR84
SCHEMBL973120 1.00
SCHEMBL19816822 1.00 HIF1A (0.53) HIF1ATSHRFAAHTRPV1GPR84
1,6-Hexanediol SCHEMBL8450098 1.00 HIF1A (0.53) HIF1ATSHRFAAHTRPV1GPR84
SCHEMBL1958838 1.00 HIF1A (0.53) HIF1ATSHRFAAHTRPV1GPR84
SCHEMBL9407145 1.00
SCHEMBL2458519 1.00 HIF1A (0.53) HIF1ATSHRFAAHTRPV1GPR84
SCHEMBL187920 1.00 HIF1A (0.53) HIF1ATSHRFAAHTRPV1GPR84

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
EP-0350921-A1 Process for producing alcohols and aldehydes UNION CARBIDE CHEMICALS AND PLASTICS COMPANY, INC. (US) 1990-01-17 EP disclosed