SCHEMBL23866134

SCHEMBL23866134

CN1CCC2CCN[C@@H]2C1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MBTD1 Q05BQ5 1/20 0.34
L3MBTL3 Q96JM7 1/20 0.34
NCF1 P14598 1/20 0.32
HRH4 Q9H3N8 1/20 0.31
GNAI3 P08754 3/20 0.30
GNAO1 P09471 3/20 0.30
GNAI1 P63096 3/20 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
SCHEMBL18967092 1.00 MBTD1 (0.34) MBTD1L3MBTL3NCF1HRH4GNAI3
SCHEMBL18967101 1.00 MBTD1 (0.34) MBTD1L3MBTL3NCF1HRH4GNAI3
SCHEMBL15338322 1.00 MBTD1 (0.34) MBTD1L3MBTL3NCF1HRH4GNAI3
SCHEMBL12560847 1.00 MBTD1 (0.34) MBTD1L3MBTL3NCF1HRH4GNAI3
Hydrochloric Acid SCHEMBL30938586 0.98 MBTD1 (0.33) MBTD1L3MBTL3NCF1HRH4GNAI3
Hydrochloric Acid SCHEMBL31430092 0.98 MBTD1 (0.33) MBTD1L3MBTL3NCF1HRH4GNAI3
SCHEMBL19343102 0.88 MBTD1 (0.33) MBTD1L3MBTL3HRH4
SCHEMBL10381139 0.88 HRH4 (0.40) MBTD1L3MBTL3NCF1HRH4
SCHEMBL12605050 0.87 MBTD1 (0.34) MBTD1L3MBTL3NCF1GNAI3GNAO1
SCHEMBL4406747 0.87 MBTD1 (0.34) MBTD1L3MBTL3NCF1GNAI3GNAO1

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
EP-3885342-A1 BICYCLIC INHIBITORS OF PAD4 Padlock Therapeutics, Inc. (US) 2021-09-29 EP disclosed