SCHEMBL29283296

SCHEMBL29283296

CCN1C(=O)CC(C(=O)O)C1c1cccnc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.46
▸ NPEPPS P55786 1/20 0.45
▸ CA1 P00915 1/20 0.44
▸ CA2 P00918 1/20 0.44
▸ CA4 P22748 1/20 0.44
▸ CA7 P43166 1/20 0.44
▸ POLB P06746 2/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ ITGB1 P05556 1/20 0.43
▸ ITGA4 P13612 1/20 0.43
▸ HTT P42858 1/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ LMNA P02545 2/20 0.41
▸ NPSR1 Q6W5P4 2/20 0.41
▸ MAPT P10636 1/20 0.41
▸ KDM4E B2RXH2 4/20 0.41
▸ CYP3A4 P08684 2/20 0.41
▸ THRB P10828 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ THPO P40225 1/20 0.41

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
SCHEMBL25029977 1.00 KMT2A (0.46) KMT2ANPEPPSCA1CA2CA4
SCHEMBL31139900 1.00 KMT2A (0.46) KMT2ANPEPPSCA1CA2CA4
SCHEMBL29283299 1.00 KMT2A (0.46) KMT2ANPEPPSCA1CA2CA4
SCHEMBL31467338 1.00 KMT2A (0.46) KMT2ANPEPPSCA1CA2CA4
SCHEMBL5685793 0.90 MEN1 (0.50) KMT2ANPEPPSPOLBMEN1ITGB1
SCHEMBL25028402 0.90 MEN1 (0.50) KMT2ANPEPPSPOLBMEN1ITGB1
SCHEMBL10692607 0.85 KMT2A (0.56) KMT2ACA1CA2CA4CA7
SCHEMBL2637055 0.83 ITGB1 (0.52) KMT2ANPEPPSMEN1ITGB1ITGA4
SCHEMBL12549091 0.83 ITGB1 (0.52) KMT2ANPEPPSMEN1ITGB1ITGA4
SCHEMBL14003349 0.83 ITGB1 (0.52) KMT2ANPEPPSMEN1ITGB1ITGA4

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-118103074-A Cytotoxic targeting chimeras for CCR2 expressing cells 葛兰素史克知识产权发展有限公司 2024-05-28 — — CN disclosed
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