SCHEMBL29045381

SCHEMBL29045381

CCCC(N)CCCCC(=O)NC1CCN(C)C(C)(C)C1C

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.40
TRPV1 Q8NER1 6/20 0.36
CNR1 P21554 4/20 0.36
CNR2 P34972 4/20 0.36
DPP4 P27487 2/20 0.32
METAP1 P53582 1/20 0.32
GNAI3 P08754 1/20 0.31
GNAO1 P09471 1/20 0.31
GNAI1 P63096 1/20 0.31
FAP Q12884 1/20 0.31
DPP8 Q6V1X1 1/20 0.31
DPP9 Q86TI2 1/20 0.31
DPP7 Q9UHL4 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL29045390 0.81 TRPV1 (0.38) TRPV1CNR1CNR2GNAI3GNAO1
SCHEMBL29210025 0.78 ALDH1A1 (0.36) ALDH1A1TRPV1CNR1CNR2SMN1; SMN2
SCHEMBL29175693 0.74 POLB (0.31)
SCHEMBL29045372 0.74 FUCA1 (0.35) METAP1GNAI3GNAO1GNAI1
SCHEMBL29013931 0.72 DPP4 (0.32) DPP4METAP1FAPDPP8DPP9
SCHEMBL28889498 0.68 POLB (0.33)
SCHEMBL29246891 0.65
SCHEMBL28631637 0.65 TEAD1 (0.32)
SCHEMBL29006832 0.64 TAS1R3 (0.33)
SCHEMBL22660895 0.62 FUCA1 (0.41) GNAI3GNAO1GNAI1

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
CN-116478451-A Antioxidant with light stability and thermo-oxidative aging resistance and preparation method thereof 万华化学(宁波)有限公司 2023-07-25 CN disclosed