SCHEMBL30526488

SCHEMBL30526488

CCCCCCCC(=O)N[C@H]1CCCC[C@@H]1O

nearest known ligand 0.71

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 10/20 0.71
CNR1 P21554 8/20 0.71
CNR2 P34972 8/20 0.71
GNAI3 P08754 1/20 0.51
GNAO1 P09471 1/20 0.51
GNAI1 P63096 1/20 0.51
CCR2 P41597 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.49

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
SCHEMBL30526485 1.00 TRPV1 (0.71) TRPV1CNR1CNR2GNAI3GNAO1
SCHEMBL4135887 1.00 TRPV1 (0.71) TRPV1CNR1CNR2GNAI3GNAO1
SCHEMBL4135884 1.00 TRPV1 (0.71) TRPV1CNR1CNR2GNAI3GNAO1
SCHEMBL4133182 1.00 TRPV1 (0.71) TRPV1CNR1CNR2GNAI3GNAO1
SCHEMBL4133180 1.00 TRPV1 (0.71) TRPV1CNR1CNR2GNAI3GNAO1
SCHEMBL9209547 1.00 TRPV1 (0.71) TRPV1CNR1CNR2GNAI3GNAO1
SCHEMBL30526486 0.98 TRPV1 (0.68) TRPV1CNR1CNR2GNAI3GNAO1
SCHEMBL30526484 0.93 TRPV1 (0.60) TRPV1CNR1CNR2GNAI3GNAO1
SCHEMBL9204695 0.92 TRPV1 (0.75) TRPV1CNR1CNR2
SCHEMBL9212430 0.92 TRPV1 (0.75) TRPV1CNR1CNR2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116554079-B Histone deacetylase inhibitor and application thereof 南京市鸿舜医药科技有限公司 2023-11-10 CN claimed
CN-116554079-A Histone deacetylase inhibitor and application thereof 南京市鸿舜医药科技有限公司 2023-08-08 CN claimed
CN-116554079-B Histone deacetylase inhibitor and application thereof 南京市鸿舜医药科技有限公司 2023-11-10 CN disclosed
CN-116554079-A Histone deacetylase inhibitor and application thereof 南京市鸿舜医药科技有限公司 2023-08-08 CN disclosed