SCHEMBL28820037

SCHEMBL28820037

NNC=O.c1ccc(-c2nnco2)cc1

nearest known ligand 0.70

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NOTUM Q6P988 14/20 0.70
▸ TLR8 Q9NR97 1/20 0.53
▸ TSHR P16473 1/20 0.45
▸ TP53 P04637 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL9555 0.84 NOTUM (1.00) NOTUMTLR8TSHRKDM4EALDH1A1
Biphenyl SCHEMBL22577775 0.82 NOTUM (0.95) NOTUMTLR8TSHRKDM4EALDH1A1
SCHEMBL5571187 0.80 NOTUM (0.91) NOTUMTLR8TSHRKDM4EALDH1A1
Acetamide SCHEMBL28274790 0.78 NOTUM (0.72) NOTUMTLR8TSHRKDM4EALDH1A1
SCHEMBL6851980 0.75 NOTUM (0.58) NOTUMTLR8TSHRTP53KDM4E
Ethoxycarbonyl Group SCHEMBL27868448 0.75 NOTUM (0.62) NOTUMTLR8TSHRTP53KDM4E
SCHEMBL3970760 0.74 NOTUM (0.78) NOTUMTLR8TSHRKDM4EALDH1A1
Biphenyl SCHEMBL29204213 0.73 ALDH1A1 (0.50) NOTUMTP53ALDH1A1LMNAMAPT
SCHEMBL17694561 0.73 NOTUM (0.78) NOTUMTLR8TSHRTP53KDM4E
SCHEMBL17197374 0.72 NOTUM (0.74) NOTUMTLR8TSHRTP53KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104736535-A Heterocyclic modulators of hif activity for treatment of disease JONES PHILIP 2015-06-24 — — CN disclosed
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