SCHEMBL28841378

SCHEMBL28841378

CCOc1ccc(C(=O)CN2C=CN(C)C2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 2/20 0.51
▸ ALDH1A1 P00352 10/20 0.51
▸ HPGD P15428 3/20 0.51
▸ LMNA P02545 2/20 0.51
▸ TP53 P04637 2/20 0.51
▸ L3MBTL1 Q9Y468 2/20 0.51
▸ TSHR P16473 2/20 0.51
▸ HSD17B10 Q99714 2/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ MAPT P10636 2/20 0.50
▸ USP2 O75604 1/20 0.50
▸ HTT P42858 1/20 0.50
▸ KDM4E B2RXH2 1/20 0.47
▸ PARP10 Q53GL7 1/20 0.46
▸ PKM P14618 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ GAA P10253 3/20 0.45
▸ CYP1A2 P05177 1/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ CYP2D6 P10635 1/20 0.45

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
Bromide SCHEMBL10529121 0.99 ALDH1A1 (0.50) NPC1ALDH1A1HPGDLMNATP53
Bromide SCHEMBL10526719 0.88 L3MBTL1 (0.52) ALDH1A1LMNAL3MBTL1TSHRKMT2A
SCHEMBL28841407 0.86 ALDH1A1 (0.54) NPC1ALDH1A1LMNAKMT2AMAPT
Bromide SCHEMBL3853194 0.84 ALDH1A1 (0.56) NPC1ALDH1A1LMNAKMT2AMAPT
SCHEMBL10529177 0.84 RAB9A (0.44) NPC1ALDH1A1HPGDLMNATP53
Bromide SCHEMBL10528609 0.83 RAB9A (0.44) NPC1ALDH1A1HPGDLMNATP53
SCHEMBL10526836 0.81 RAB9A (0.47) NPC1ALDH1A1HPGDLMNAL3MBTL1
SCHEMBL10531146 0.81 KMT2A (0.50) NPC1ALDH1A1TP53L3MBTL1TSHR
Bromide SCHEMBL10529207 0.80 RAB9A (0.49) NPC1ALDH1A1HPGDLMNAL3MBTL1
Bromide SCHEMBL10528564 0.80 KMT2A (0.49) NPC1ALDH1A1TP53L3MBTL1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108690217-B Carbon fiber recycling composition and method 波音公司 2022-07-15 — — CN claimed
CN-108690217-B Carbon fiber recycling composition and method 波音公司 2022-07-15 — — CN disclosed
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