SCHEMBL25544495

SCHEMBL25544495

CCn1c(=O)[nH]c2cc(CO)ncc2c1=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 3/20 0.49
▸ ALDH1A1 P00352 9/20 0.43
▸ KMT2A Q03164 6/20 0.43
▸ MEN1 O00255 5/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ PDE4A P27815 2/20 0.40
▸ ADORA2A P29274 2/20 0.40
▸ PDE4B Q07343 2/20 0.40
▸ PDE4C Q08493 2/20 0.40
▸ PDE4D Q08499 2/20 0.40
▸ KDM4E B2RXH2 5/20 0.39
▸ HSD17B10 Q99714 4/20 0.39
▸ POLB P06746 2/20 0.39
▸ LMNA P02545 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ NFKB1 P19838 1/20 0.39
▸ BLM P54132 1/20 0.39
▸ PMP22 Q01453 1/20 0.39

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
SCHEMBL25544465 0.80 CYP1A2 (0.51) CYP1A2ALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL25544494 0.76 KMT2A (0.48) CYP1A2ALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL25280376 0.74 CYP1A2 (0.59) CYP1A2ALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL15624105 0.71 CYP1A2 (0.62) CYP1A2ALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL30819375 0.69 CYP1A2 (0.64) CYP1A2ALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL31207287 0.68 CYP1A2 (0.62) CYP1A2ALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL25093203 0.68 CYP1A2 (0.62) CYP1A2ALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL19199990 0.68 CYP1A2 (0.54) CYP1A2ALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL27202845 0.68 ALDH1A1 (0.74) CYP1A2ALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL6392970 0.67 CYP1A2 (0.56) CYP1A2ALDH1A1KMT2AMEN1SMN1; SMN2

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-2023096915-A1 MULTICYCLIC COMPOUNDS SLAP PHARMACEUTICALS LLC (US) 2023-06-01 — — WO disclosed
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