SCHEMBL31336313

SCHEMBL31336313

CCC#CCCCCC=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.48
FAAH O00519 2/20 0.43
TRPV1 Q8NER1 2/20 0.43
HIF1A Q16665 1/20 0.41
ALDH1A1 P00352 3/20 0.38
PTPN7 P35236 4/20 0.33
HMGCR P04035 3/20 0.33
TDP1 Q9NUW8 3/20 0.31
MAPT P10636 2/20 0.31
RECQL P46063 2/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
USP2 O75604 1/20 0.31
POLB P06746 1/20 0.31
HPGD P15428 1/20 0.31
ALOX12 P18054 1/20 0.31
BLM P54132 1/20 0.31
KMT2A Q03164 1/20 0.31
MCL1 Q07820 1/20 0.31
SMN1; SMN2 Q16637 1/20 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
SCHEMBL19399753 0.93
SCHEMBL11042234 0.85 TSHR (0.50) TSHRFAAHTRPV1HIF1AALDH1A1
SCHEMBL1300728 0.84 TSHR (0.65) TSHRFAAHTRPV1HIF1AALDH1A1
SCHEMBL2734292 0.84 TSHR (0.73) TSHRFAAHTRPV1ALDH1A1PTPN7
SCHEMBL28013202 0.84 TSHR (0.73) TSHRFAAHTRPV1ALDH1A1PTPN7
SCHEMBL2734169 0.84 TSHR (0.73) TSHRFAAHTRPV1ALDH1A1PTPN7
SCHEMBL19432892 0.84 TSHR (0.73) TSHRFAAHTRPV1ALDH1A1PTPN7
SCHEMBL4384813 0.84 TSHR (0.73) TSHRFAAHTRPV1ALDH1A1PTPN7
SCHEMBL2734276 0.84 TSHR (0.65) TSHRFAAHTRPV1HIF1AALDH1A1
SCHEMBL4355698 0.84 TSHR (0.73) TSHRFAAHTRPV1ALDH1A1PTPN7

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
EP-4720023-A1 FRAGRANCE PRECURSOR COMPOUNDS Givaudan SA (CH) 2026-04-08 EP disclosed
WO-2024245610-A1 FRAGRANCE PRECURSOR COMPOUNDS GIVAUDAN SA (CH) 2024-12-05 WO disclosed