SCHEMBL31405830

SCHEMBL31405830

C=CC(=O)OC(C)CCCCCC.C=CC(=O)OCCCCCCCCCC

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.60
HPGD P15428 1/20 0.60
ALDH1A1 P00352 3/20 0.56
CYP3A4 P08684 1/20 0.56
FAAH O00519 5/20 0.49
HCAR2 Q8TDS4 2/20 0.46
CNR1 P21554 1/20 0.44
CNR2 P34972 1/20 0.44
ATM Q13315 1/20 0.42
ABCB1 P08183 1/20 0.42
NAAA Q02083 1/20 0.41
TP53 P04637 1/20 0.40
HIF1A Q16665 1/20 0.40

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
SCHEMBL8505774 1.00 TSHR (0.60) TSHRHPGDALDH1A1CYP3A4FAAH
SCHEMBL7789531 0.97 TSHR (0.60) TSHRHPGDALDH1A1CYP3A4FAAH
SCHEMBL10867522 0.94 TSHR (0.63) TSHRHPGDALDH1A1CYP3A4FAAH
SCHEMBL31636154 0.94 TSHR (0.63) TSHRHPGDALDH1A1CYP3A4FAAH
SCHEMBL6731836 0.92 TSHR (0.60) TSHRHPGDALDH1A1CYP3A4FAAH
SCHEMBL31589101 0.92 TSHR (0.50) TSHRHPGDALDH1A1CYP3A4FAAH
SCHEMBL11030271 0.91 TSHR (0.69) TSHRHPGDALDH1A1CYP3A4FAAH
SCHEMBL2316134 0.91 FAAH (0.53) TSHRHPGDALDH1A1FAAHCNR1
SCHEMBL5072994 0.91 FAAH (0.53) TSHRHPGDALDH1A1FAAHCNR1
SCHEMBL375397 0.91 FAAH (0.53) TSHRHPGDALDH1A1FAAHCNR1

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
WO-2025059545-A1 BIOMATERIAL-BASED ELASTOMERIC MATERIALS THE FYNDER GROUP, INC. (US) 2025-03-20 WO disclosed
US-20250084587-A1 BIOMATERIAL-BASED ELASTOMERIC MATERIALS THE FYNDER GROUP, INC. 2025-03-13 US disclosed