SCHEMBL29357592

SCHEMBL29357592

N#Cc1c[nH]n2c(=O)[nH]c(=S)nc12

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ KDM5A P29375 5/20 0.52
▸ KDM4E B2RXH2 2/20 0.49
▸ ALDH1A1 P00352 2/20 0.49
▸ LMNA P02545 1/20 0.49
▸ HSD17B10 Q99714 1/20 0.49
▸ CYP2C9 P11712 1/20 0.49
▸ KDM5B Q9UGL1 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
SCHEMBL31376518 0.65 KDM5A (0.55) KDM5AKDM4EALDH1A1LMNAHSD17B10
SCHEMBL826541 0.62 KDM5A (0.58) KDM5AKDM4EALDH1A1LMNAHSD17B10
Hydrochloric Acid SCHEMBL31236648 0.62 KDM5A (0.98) KDM5AKDM5B
SCHEMBL6642827 0.61 KDM5A (0.50) KDM5AKDM4EALDH1A1LMNAHSD17B10
SCHEMBL187437 0.54 DPYD (0.64) KDM4EALDH1A1
SCHEMBL31153943 0.54 PLAT (0.45) KDM5AKDM4EALDH1A1
SCHEMBL29118313 0.50 — —
SCHEMBL3825045 0.49 CHUK (0.45) KDM4EALDH1A1
SCHEMBL12342961 0.49 KMT2A (0.51) KDM4EALDH1A1HSD17B10
SCHEMBL189451 0.49 DPYD (1.00) KDM4EALDH1A1LMNA

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
CN-109562111-B CK2 inhibitors, compositions and methods thereof 北极星药业股份有限公司 2023-04-04 — — CN disclosed
EP-3474855-B1 CK2 INHIBITORS, COMPOSITIONS AND METHODS THEREOF POLARIS PHARMACEUTICALS INC (US) 2022-01-26 — — EP disclosed
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