SCHEMBL23387387

SCHEMBL23387387

O=C(Cc1ccc(C2CC2)cc1)N[C@H]1CN(C(=O)O)C[C@@H]1F

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.38
▸ POLB P06746 3/20 0.38
▸ CCR1 P32246 4/20 0.38
▸ LMNA P02545 2/20 0.37
▸ RORC P51449 1/20 0.37
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ CACNA1G O43497 1/20 0.36
▸ CACNA1H O95180 1/20 0.36
▸ CACNA1I Q9P0X4 1/20 0.36
▸ SIGMAR1 Q99720 2/20 0.36
▸ PANK3 Q9H999 1/20 0.36
▸ EPHX2 P34913 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 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
SCHEMBL29689797 0.83 USP30 (0.53) RORCCACNA1GCACNA1HCACNA1I
SCHEMBL21624785 0.77 USP30 (0.49) ALDH1A1POLBLMNAMEN1KMT2A
SCHEMBL21624784 0.77 USP30 (0.49) ALDH1A1POLBLMNAMEN1KMT2A
SCHEMBL23387269 0.75 CYP3A4 (0.47) POLBLMNARORCCACNA1GCACNA1H
SCHEMBL31332321 0.72 USP30 (0.34) —
SCHEMBL23387172 0.72 ACACB (0.40) CACNA1GCACNA1HCACNA1ISIGMAR1
SCHEMBL23387284 0.69 HRH3 (0.43) ALDH1A1POLBLMNAMEN1KMT2A
SCHEMBL21199564 0.68 DPP4 (0.55) ALDH1A1
SCHEMBL21199008 0.68 DPP4 (0.55) ALDH1A1
SCHEMBL16740675 0.68 DPP4 (0.55) ALDH1A1

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-3825303-A1 T-TYPE CALCIUM CHANNEL BLOCKER Nippon Chemiphar Co., Ltd. (JP) 2021-05-26 — — EP disclosed
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