SCHEMBL27491756

SCHEMBL27491756

COc1ccc2nc(Cl)cc(C(=O)O)c2c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 9/20 0.71
▸ ALDH1A1 P00352 5/20 0.71
▸ POLB P06746 4/20 0.71
▸ HPGD P15428 3/20 0.71
▸ HSD17B10 Q99714 3/20 0.71
▸ LMNA P02545 2/20 0.62
▸ PLA2G2A P14555 3/20 0.56
▸ KMT2A Q03164 3/20 0.52
▸ SMN1; SMN2 Q16637 4/20 0.51
▸ CYP1A2 P05177 1/20 0.51
▸ TSHR P16473 1/20 0.51
▸ DHODH Q02127 1/20 0.51
▸ MAPT P10636 2/20 0.50
▸ CYP2D6 P10635 1/20 0.50
▸ CYP2C9 P11712 1/20 0.50
▸ NPC1 O15118 1/20 0.50
▸ NFKB1 P19838 1/20 0.50
▸ RAB9A P51151 1/20 0.50
▸ NFKB2 Q00653 1/20 0.50
▸ RELA Q04206 1/20 0.50

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
SCHEMBL15798322 0.83 KDM4E (0.73) KDM4EALDH1A1POLBHPGDHSD17B10
SCHEMBL23858700 0.83 KDM4E (1.00) KDM4EALDH1A1POLBHPGDHSD17B10
SCHEMBL15129579 0.83 KDM4E (0.73) KDM4EALDH1A1POLBHPGDHSD17B10
SCHEMBL27491071 0.81 KDM4E (0.51) KDM4EALDH1A1POLBHPGDHSD17B10
SCHEMBL2539829 0.81 KDM4E (0.60) KDM4EALDH1A1POLBHPGDHSD17B10
SCHEMBL16832417 0.79 KDM4E (0.72) KDM4EALDH1A1POLBHPGDHSD17B10
SCHEMBL28130384 0.79 KDM4E (0.68) KDM4EALDH1A1POLBHPGDHSD17B10
SCHEMBL830265 0.79 SMN1; SMN2 (0.48) KDM4EALDH1A1POLBHPGDHSD17B10
SCHEMBL22468804 0.79 ALDH1A1 (0.67) KDM4EALDH1A1POLBHPGDHSD17B10
SCHEMBL29420513 0.79 SMN1; SMN2 (0.48) KDM4EALDH1A1POLBHPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115108624-A Ferrocene selenide/TiO 2 Application of quasi-composite photocatalyst in purifying pollutants in water system 南京工业大学 2022-09-27 — — CN disclosed
CN-107406580-B Resin composition for sealing, semiconductor device, and structure 住友电木株式会社 2020-01-24 — — CN disclosed
CN-1193016-C Process for synthesizing inhibitor of phosphatidase A2 UNIV BEIJING (CN) 2005-03-16 — — CN disclosed
CN-1502609-A Process for synthesizing inhibitor of phosphatidase A2 北京大学 2004-06-09 — — CN disclosed
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