SCHEMBL30155014

SCHEMBL30155014

N#Cc1ccc2ncc([N+](=O)[O-])cc2c1

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.58
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
VCAM1 P19320 2/20 0.46
RAD51 Q06609 1/20 0.45
ABCG2 Q9UNQ0 4/20 0.43
GAA P10253 1/20 0.40
HTT P42858 1/20 0.40

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
SCHEMBL27458114 0.88 ALDH1A1 (0.50) ALDH1A1MEN1KMT2AVCAM1RAD51
SCHEMBL28110970 0.76 ALDH1A1 (0.63) ALDH1A1MEN1KMT2AABCG2
SCHEMBL30129995 0.76 ALDH1A1 (0.63) ALDH1A1MEN1KMT2AHTT
SCHEMBL360009 0.76 ALDH1A1 (0.63) ALDH1A1MEN1KMT2AHTT
SCHEMBL28110425 0.76 ALDH1A1 (0.63) ALDH1A1MEN1KMT2AGAAHTT
SCHEMBL29620071 0.76 ALDH1A1 (0.63) ALDH1A1MEN1KMT2AHTT
SCHEMBL4866756 0.76 ALDH1A1 (0.63) ALDH1A1MEN1KMT2AGAAHTT
SCHEMBL2810966 0.76 ALDH1A1 (0.63) ALDH1A1MEN1KMT2AHTT
SCHEMBL27569712 0.76 HPGDS (0.52) ALDH1A1MEN1KMT2AVCAM1RAD51
SCHEMBL29642602 0.74 ALDH1A1 (1.00) ALDH1A1MEN1KMT2AHTT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4522615-A1 LRRK2 INHIBITORS Interline Therapeutics, Inc. (US) 2025-03-19 EP disclosed
WO-2023220238-A1 LRRK2 INHIBITORS INTERLINE THERAPEUTICS, INC. (US) 2023-11-16 WO disclosed
CN-111051304-B Imidazo [4,5-c ] quinoline derivatives as LRRK2 inhibitors 辉瑞大药厂 2022-12-27 CN disclosed