SCHEMBL31055362

SCHEMBL31055362

CC(C)CCCCCCCCCCCCCCCN.NCCCNO

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NMT2 O60551 1/20 0.38
NMT1 P30419 1/20 0.38
GNAI3 P08754 1/20 0.38
GNAO1 P09471 1/20 0.38
GNAI1 P63096 1/20 0.38
TRPV1 Q8NER1 1/20 0.37
TRPA1 O75762 1/20 0.37
PAOX Q6QHF9 2/20 0.36
CA12 O43570 3/20 0.36
CA1 P00915 3/20 0.36
CA2 P00918 3/20 0.36
CA3 P07451 3/20 0.36
CA4 P22748 3/20 0.36
CA6 P23280 3/20 0.36
CA5A P35218 3/20 0.36
CA7 P43166 3/20 0.36
CA9 Q16790 3/20 0.36
CA14 Q9ULX7 3/20 0.36
CA5B Q9Y2D0 3/20 0.36
LMNA P02545 2/20 0.36

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
SCHEMBL3014043 0.84 LMNA (0.43) TRPV1TRPA1LMNA
SCHEMBL21847064 0.82
SCHEMBL19468447 0.82 DNM1 (0.50) TRPV1TRPA1CA12CA1CA2
SCHEMBL19468521 0.82 DNM1 (0.50) TRPV1TRPA1CA12CA1CA2
SCHEMBL19946206 0.82 DNM1 (0.50) TRPV1TRPA1CA12CA1CA2
SCHEMBL19468478 0.82 DNM1 (0.50) TRPV1TRPA1CA12CA1CA2
SCHEMBL1507436 0.82 DNM1 (0.50) TRPV1TRPA1CA12CA1CA2
SCHEMBL19946200 0.82 DNM1 (0.50) TRPV1TRPA1CA12CA1CA2
SCHEMBL19946211 0.82 DNM1 (0.50) TRPV1TRPA1CA12CA1CA2
SCHEMBL238797 0.82 DNM1 (0.50) TRPV1TRPA1CA12CA1CA2

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
CN-118477023-A Repairing agent and microemulsion with anti-wrinkle effect, composition, and preparation methods and applications thereof 麦吉丽生物科技有限公司 2024-08-13 CN claimed
CN-118477023-A Repairing agent and microemulsion with anti-wrinkle effect, composition, and preparation methods and applications thereof 麦吉丽生物科技有限公司 2024-08-13 CN disclosed