SCHEMBL30310328

SCHEMBL30310328

O=C(O)c1cc2ccc(Cl)cc2[nH]1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F7 P08709 1/20 0.74
F3 P13726 1/20 0.74
ALOX15 P16050 7/20 0.66
KDM4E B2RXH2 2/20 0.63
HPGD P15428 2/20 0.63
MEN1 O00255 1/20 0.63
LMNA P02545 1/20 0.63
CYP2C9 P11712 1/20 0.63
MAPK1 P28482 1/20 0.63
BLM P54132 1/20 0.63
KMT2A Q03164 1/20 0.63
GRIN1 Q05586 2/20 0.61
GRIN2D O15399 1/20 0.61
GRIN3B O60391 1/20 0.61
GRIN2A Q12879 1/20 0.61
GRIN2B Q13224 1/20 0.61
GRIN2C Q14957 1/20 0.61
GRIN3A Q8TCU5 1/20 0.61
DAO P14920 2/20 0.59
MAPT P10636 1/20 0.59

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
SCHEMBL671001 1.00 F7 (0.74) F7F3ALOX15KDM4EHPGD
SCHEMBL30071319 0.86 F7 (0.61) F7F3ALOX15KDM4EHPGD
SCHEMBL3500068 0.86 F7 (0.61) F7F3ALOX15KDM4EHPGD
5-Chloroindole-2-Carboxylic Acid SCHEMBL720582 0.85 F7 (1.00) F7F3KDM4EHPGDMEN1
SCHEMBL23835754 0.84 ALOX15 (0.69) F7F3ALOX15KDM4EHPGD
5-Chloroindole-2-Carboxylic Acid SCHEMBL6921825 0.84 F7 (0.96) F7F3KDM4EHPGDMEN1
SCHEMBL29062810 0.84 ALOX15 (0.64) F7F3ALOX15KDM4EHPGD
SCHEMBL6170605 0.82 MEN1 (0.78) F7F3ALOX15MEN1CYP2C9
SCHEMBL16795745 0.81 ALOX15 (0.61) F7F3ALOX15MEN1MAPK1
SCHEMBL6170035 0.81 MEN1 (0.63) F7F3ALOX15MEN1KMT2A

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-2023086350-A1 ALKYNE-CONTAINING ANTIVIRAL AGENTS ENANTA PHARMACEUTICALS, INC. (US) 2023-05-19 WO disclosed
EP-4161902-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF Pardes Biosciences, Inc. (US) 2023-04-12 EP disclosed