SCHEMBL30228654

SCHEMBL30228654

COCc1cc(C)c2c(-c3ccccc3C)cc(=O)oc2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNA3 P22001 3/20 0.44
▸ ALDH1A1 P00352 12/20 0.43
▸ MAPT P10636 6/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ TDP1 Q9NUW8 2/20 0.38
▸ PKM P14618 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ MAOA P21397 1/20 0.38
▸ MAOB P27338 1/20 0.38
▸ CASP3 P42574 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ SENP8 Q96LD8 1/20 0.38
▸ SENP7 Q9BQF6 1/20 0.38
▸ SENP6 Q9GZR1 1/20 0.38
▸ HPGD P15428 2/20 0.38
▸ HSD17B10 Q99714 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ LMNA P02545 1/20 0.38

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
SCHEMBL30228504 0.84 ALDH1A1 (0.52) KCNA3ALDH1A1MAPTSMN1; SMN2HTT
SCHEMBL30227920 0.82 KCNA3 (0.53) KCNA3ALDH1A1TDP1NPC1MAOA
SCHEMBL30228405 0.80 CA9 (0.56) KCNA3ALDH1A1MAPTMAOAMAOB
SCHEMBL30231539 0.76 IGLV6-57 (0.44) KCNA3ALDH1A1MAPTSMN1; SMN2TDP1
SCHEMBL30228286 0.75 KCNA3 (0.47) KCNA3ALDH1A1MAPTMAOAHPGD
SCHEMBL30228422 0.74 KCNA3 (0.46) KCNA3ALDH1A1MAPTHPGDHSD17B10
SCHEMBL31711138 0.71 MAPT (0.42) KCNA3ALDH1A1MAPTSMN1; SMN2TDP1
SCHEMBL30228381 0.69 KCNA3 (0.56) KCNA3ALDH1A1SMN1; SMN2TDP1L3MBTL1
Hydrochloric Acid SCHEMBL30228355 0.68 KCNA3 (0.55) KCNA3ALDH1A1SMN1; SMN2TDP1L3MBTL1
SCHEMBL30228412 0.68 KCNA3 (0.62) KCNA3ALDH1A1SMN1; SMN2TDP1L3MBTL1

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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