SCHEMBL5332450

SCHEMBL5332450

Cc1cc(OC(C)C(=O)O)c2c(-c3ccccc3)cc(=O)oc2c1

nearest known ligand 0.78

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 13/20 0.78
▸ HPGD P15428 7/20 0.78
▸ KDM4E B2RXH2 5/20 0.66
▸ HSD17B10 Q99714 4/20 0.66
▸ RAB9A P51151 1/20 0.66
▸ MAPT P10636 2/20 0.64
▸ SMN1; SMN2 Q16637 1/20 0.64
▸ KMT2A Q03164 4/20 0.62
▸ MAPK1 P28482 2/20 0.62
▸ ALOX15 P16050 1/20 0.60
▸ TSHR P16473 1/20 0.60
▸ POLB P06746 1/20 0.60
▸ HTT P42858 1/20 0.53
▸ NPSR1 Q6W5P4 1/20 0.53
▸ MEN1 O00255 1/20 0.51
▸ APEX1 P27695 1/20 0.50
▸ RECQL P46063 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
SCHEMBL30227915 0.90 ALDH1A1 (0.64) ALDH1A1HPGDKDM4EHSD17B10RAB9A
SCHEMBL5329981 0.81 ALDH1A1 (0.60) ALDH1A1HPGDKDM4EHSD17B10RAB9A
SCHEMBL5327950 0.80 ALDH1A1 (0.85) ALDH1A1HPGDKDM4EHSD17B10MAPT
SCHEMBL30228241 0.78 ALDH1A1 (0.57) ALDH1A1HPGDKDM4EHSD17B10RAB9A
SCHEMBL30228252 0.78 ALDH1A1 (0.57) ALDH1A1HPGDKDM4EHSD17B10RAB9A
SCHEMBL21630173 0.78 ALDH1A1 (0.68) ALDH1A1HPGDKDM4EKMT2AMAPK1
SCHEMBL13780711 0.78 POLB (0.74) ALDH1A1HPGDKDM4EHSD17B10SMN1; SMN2
SCHEMBL25449219 0.76 MAPT (0.77) ALDH1A1HPGDHSD17B10MAPTSMN1; SMN2
SCHEMBL21629582 0.75 POLB (0.86) ALDH1A1HPGDKDM4EHSD17B10RAB9A
SCHEMBL21629540 0.75 ALDH1A1 (1.00) ALDH1A1HPGDKDM4ERAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007144625-A1 2-OXO-2H-CHROMENE COMPOUNDS ARGENTA DISCOVERY LIMITED (GB) 2007-12-21 — — WO claimed
WO-2007144625-A1 2-OXO-2H-CHROMENE COMPOUNDS ARGENTA DISCOVERY LIMITED (GB) 2007-12-21 — — WO disclosed
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