SCHEMBL30228207

SCHEMBL30228207

Cc1ccccc1-c1cc(=O)oc2cc(N(C)Cc3ccccn3)ccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IGLV6-57 P01721 5/20 0.47
▸ KCNA3 P22001 1/20 0.45
▸ ALDH1A1 P00352 5/20 0.43
▸ KMT2A Q03164 4/20 0.43
▸ CYP3A4 P08684 3/20 0.43
▸ KDM4E B2RXH2 3/20 0.43
▸ GLA P06280 2/20 0.43
▸ CYP1A2 P05177 2/20 0.43
▸ CYP2D6 P10635 2/20 0.43
▸ CYP2C9 P11712 2/20 0.43
▸ CYP2C19 P33261 2/20 0.43
▸ GAA P10253 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ HPGD P15428 3/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ HSD17B3 P37058 1/20 0.41
▸ HSD17B10 Q99714 3/20 0.40
▸ HIF1A Q16665 2/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ CASP1 P29466 1/20 0.40

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
SCHEMBL30228039 0.84 IGLV6-57 (0.46) IGLV6-57KCNA3ALDH1A1KMT2ACYP3A4
SCHEMBL30228373 0.84 KCNA3 (0.46) IGLV6-57KCNA3ALDH1A1KMT2ACYP3A4
SCHEMBL30228287 0.84 IGLV6-57 (0.46) IGLV6-57KCNA3ALDH1A1KMT2ACYP3A4
SCHEMBL30227962 0.84 IGLV6-57 (0.46) IGLV6-57KCNA3ALDH1A1CYP3A4KDM4E
SCHEMBL31710568 0.84 IGLV6-57 (0.52) IGLV6-57KCNA3ALDH1A1KMT2ACYP3A4
SCHEMBL30228360 0.83 IGLV6-57 (0.47) IGLV6-57KCNA3ALDH1A1CYP3A4KDM4E
SCHEMBL30228402 0.82 IGLV6-57 (0.46) IGLV6-57KCNA3ALDH1A1KMT2ACYP3A4
SCHEMBL30228077 0.79 KCNA3 (0.56) IGLV6-57KCNA3ALDH1A1KMT2ACYP3A4
SCHEMBL30228594 0.79 IGLV6-57 (0.45) IGLV6-57KCNA3ALDH1A1KMT2ACYP3A4
SCHEMBL30227938 0.78 IGLV6-57 (0.51) IGLV6-57KCNA3ALDH1A1KMT2ACYP3A4

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
WO-2023034346-A1 CHROMEN-2-ONE MODULATORS OF POLRMT PRETZEL THERAPEUTICS, INC. (US) 2023-03-09 — — WO disclosed
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