SCHEMBL31589566

SCHEMBL31589566

Nc1ncc(C(=O)N(c2ccc(F)cc2C2CC2)c2ccc([N+](=O)[O-])c3nonc23)cn1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 8/20 0.37
▸ TDO2 P48775 5/20 0.37
▸ MEN1 O00255 4/20 0.37
▸ KMT2A Q03164 4/20 0.37
▸ GSTP1 P09211 6/20 0.35
▸ GSTM2 P28161 6/20 0.35
▸ MYC P01106 3/20 0.35
▸ MAX P61244 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ CASP6 P55212 1/20 0.33
▸ HBB P68871 1/20 0.33
▸ PAX8 Q06710 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ HIF1A Q16665 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33

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
SCHEMBL31589270 0.90 IDO1 (0.38) IDO1TDO2MEN1KMT2AGSTP1
SCHEMBL31589361 0.89 IDO1 (0.45) IDO1TDO2MEN1KMT2AGSTP1
SCHEMBL31589310 0.88 MEN1 (0.36) IDO1TDO2MEN1KMT2AGSTP1
SCHEMBL31589559 0.87 KMT2A (0.38) IDO1TDO2MEN1KMT2AGSTP1
SCHEMBL31589312 0.86 GSTP1 (0.45) IDO1TDO2MEN1KMT2AGSTP1
SCHEMBL31589421 0.86 IDO1 (0.48) IDO1TDO2MEN1KMT2AGSTP1
SCHEMBL31589894 0.85 IDO1 (0.36) IDO1TDO2MEN1KMT2AGSTP1
SCHEMBL31589495 0.84 IDO1 (0.40) IDO1TDO2MEN1KMT2AGSTP1
SCHEMBL31590065 0.84 IDO1 (0.43) IDO1TDO2MEN1KMT2AGSTP1
SCHEMBL31589214 0.84 MEN1 (0.41) IDO1TDO2MEN1KMT2AGSTP1

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-120040371-A Compound capable of degrading MYC in targeted manner and application thereof 中国医学科学院医药生物技术研究所 2025-05-27 — — CN disclosed
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