SCHEMBL22235426

SCHEMBL22235426

Cn1c2c(cc(C(=O)O)c1=O)[C@H](C(C)(C)C)Cc1c-2nc(Cl)c2ccccc12

nearest known ligand 0.32

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 5/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ POLB P06746 1/20 0.32
▸ ADORA1 P30542 1/20 0.31
▸ ACACB O00763 1/20 0.31
▸ ACACA Q13085 1/20 0.31
▸ MEN1 O00255 2/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ DHODH Q02127 2/20 0.31
▸ GLA P06280 1/20 0.31
▸ ATM Q13315 1/20 0.31
▸ RXFP1 Q9HBX9 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ CASP1 P29466 1/20 0.31
▸ CASP7 P55210 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ HPGD P15428 1/20 0.30
▸ NCF1 P14598 1/20 0.30

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
SCHEMBL22235748 1.00 KDM4E (0.32) KDM4EALDH1A1POLBADORA1ACACB
SCHEMBL29728931 1.00 KDM4E (0.32) KDM4EALDH1A1POLBADORA1ACACB
SCHEMBL22235429 1.00 KDM4E (0.32) KDM4EALDH1A1POLBADORA1ACACB
SCHEMBL22236137 0.90 GABRG2 (0.41) KDM4EALDH1A1MEN1KMT2AGLA
SCHEMBL22235514 0.87 GABRA1 (0.35) KDM4EALDH1A1POLBMEN1KMT2A
SCHEMBL22235409 0.87 GABRA1 (0.35) KDM4EALDH1A1POLBMEN1KMT2A
SCHEMBL22235343 0.87 GABRA1 (0.35) KDM4EALDH1A1POLBMEN1KMT2A
SCHEMBL29728904 0.87 GABRA1 (0.35) KDM4EALDH1A1POLBMEN1KMT2A
SCHEMBL22235214 0.70 KDM4E (0.32) KDM4E
SCHEMBL22235212 0.70 KDM4E (0.32) KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113825756-A Substituted polycyclic carboxylic acids, analogs thereof, and methods of use thereof 爱彼特生物制药公司 2021-12-21 — — CN disclosed
EP-3911653-A1 SUBSTITUTED POLYCYCLIC CARBOXYLIC ACIDS, ANALOGUES THEREOF, AND METHODS USING SAME Arbutus Biopharma Corporation (CA) 2021-11-24 — — EP disclosed
WO-2020150366-A1 SUBSTITUTED POLYCYCLIC CARBOXYLIC ACIDS, ANALOGUES THEREOF, AND METHODS USING SAME ARBUTUS BIOPHARMA CORPORATION (CA) 2020-07-23 — — WO disclosed
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