SCHEMBL31618956

SCHEMBL31618956

O=C(O)Nc1nc(=O)[nH]cc1CO

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 3/20 0.35
▸ PNP P00491 11/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ MAPT P10636 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ STAT3 P40763 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ ADORA1 P30542 2/20 0.32
▸ APP P05067 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.30
▸ PKM P14618 1/20 0.30
▸ HTT P42858 1/20 0.30

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
SCHEMBL6449273 0.85 KMT2A (0.34) ADORA2ACYP1A2POLBCYP3A4CYP2D6
SCHEMBL18610783 0.79 MAT2A (0.33) ADORA2APNPCYP3A4CYP2C19HSD17B10
SCHEMBL12894751 0.79 ALDH1A1 (0.32) MAPTMEN1KMT2AALDH1A1HTT
SCHEMBL31429917 0.77 NOTUM (0.37) ADORA2ARAB9AKMT2AADORA1ALDH1A1
SCHEMBL30864233 0.76 KDM4E (0.37) ADORA2ACYP1A2KMT2AHSD17B10ADORA1
SCHEMBL2463445 0.75 APP (0.56) ADORA2AMAPTKMT2AADORA1APP
SCHEMBL17077972 0.71 GRIA1 (0.33) PNP
SCHEMBL546483 0.69 GRIA1 (0.32) PNP
SCHEMBL26506 0.69 SUMO1 (0.36) PNP
SCHEMBL2463433 0.68 KMT2A (0.57) CYP1A2POLBMAPTMEN1RAB9A

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-120138085-A Kit for cleavage of modified target DNA 路德维格癌症研究所 2025-06-13 — — CN disclosed
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