SCHEMBL24077090

SCHEMBL24077090

COCCn1nc(N=O)ccc1=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MPO P05164 1/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ ALDH1A1 P00352 4/20 0.35
▸ POLB P06746 1/20 0.34
▸ PTGS2 P35354 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.33
▸ HCAR3 P49019 1/20 0.33
▸ PDE4A P27815 3/20 0.33
▸ PDE4B Q07343 3/20 0.33
▸ PDE4C Q08493 3/20 0.33
▸ PDE4D Q08499 3/20 0.33
▸ CYP1A2 P05177 2/20 0.32
▸ CDK4 P11802 1/20 0.32
▸ CCND1 P24385 1/20 0.32
▸ CCND2 P30279 1/20 0.32
▸ CCND3 P30281 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32

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
SCHEMBL25746400 0.78 MPO (0.41) MPOKDM4EMEN1KMT2AALDH1A1
SCHEMBL24076248 0.77 KDM4E (0.44) MPOKDM4EMEN1KMT2AALDH1A1
SCHEMBL31366245 0.77 MPO (0.40) MPOKDM4EMEN1KMT2AALDH1A1
SCHEMBL24076322 0.77 MPO (0.40) MPOKDM4EMEN1KMT2AALDH1A1
SCHEMBL24246975 0.75 MPO (0.39) MPOKDM4EMEN1KMT2AALDH1A1
Hydrochloric Acid SCHEMBL30168555 0.75 MPO (0.39) MPOKDM4EMEN1KMT2AALDH1A1
SCHEMBL3650533 0.73 HCAR3 (0.44) MPOKDM4EMEN1KMT2AALDH1A1
SCHEMBL30949211 0.72 KMT2A (0.41) MPOKDM4EMEN1KMT2AALDH1A1
SCHEMBL28946878 0.70 KDM4E (0.40) MPOKDM4EMEN1KMT2AALDH1A1
SCHEMBL23202350 0.69 KDM4E (0.42) MPOKDM4EMEN1KMT2AALDH1A1

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
WO-2021239885-A1 COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2021-12-02 — — WO disclosed
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