SCHEMBL9505061

SCHEMBL9505061

CN1C(=CC(=O)O)N(C)c2ccccc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPA1 O75762 3/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ MTOR P42345 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ CDC25A P30304 9/20 0.40
▸ HDAC1 Q13547 1/20 0.38
▸ KDM4E B2RXH2 2/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ HSD17B10 Q99714 2/20 0.37
▸ TSHR P16473 1/20 0.37
▸ CASP1 P29466 1/20 0.37
▸ HDAC4 P56524 1/20 0.37
▸ HDAC7 Q8WUI4 1/20 0.37
▸ HDAC5 Q9UQL6 1/20 0.37
▸ EGFR P00533 1/20 0.37
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ HTT P42858 1/20 0.36
▸ MYC P01106 1/20 0.36
▸ NR4A1 P22736 1/20 0.36

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
SCHEMBL14385902 0.79 CDC25A (0.44) TRPA1NPC1MTORRAB9ACDC25A
Bicarbonate SCHEMBL7994130 0.72 HDAC4 (0.42) TRPA1NPC1MTORRAB9AALDH1A1
SCHEMBL26299717 0.70 MAOA (0.46) TRPA1NPC1MTORRAB9AKDM4E
SCHEMBL13238422 0.70 HDAC1 (0.46) HDAC1ALDH1A1TSHR
SCHEMBL10623284 0.70 LMNA (0.50) TRPA1NPC1MTORRAB9AKDM4E
SCHEMBL13636983 0.68 — —
SCHEMBL29390564 0.68 MAOA (0.60) KDM4EALDH1A1HDAC4HDAC7HDAC5
SCHEMBL482716 0.68 MAOA (0.60) KDM4EALDH1A1HDAC4HDAC7HDAC5
SCHEMBL4571020 0.68 MAOA (0.60) KDM4EALDH1A1HDAC4HDAC7HDAC5
SCHEMBL7669038 0.67 HDAC1 (0.53) RAB9AHDAC1KDM4EALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0272212-B1 PROCESS FOR CONTINUALLY PRODUCING AZO OR HYDRAZONE DYES CIBA-GEIGY AG (CH) 1993-09-01 — — EP claimed
US-4925926-A Preparation of cationic azo or hydrazone dyes in which the alkylation and the separation of the cationic dye are carried out continuously CIBA-GEIGY CORPORATION (US) 1990-05-15 — — US claimed
EP-0272212-A2 Process for continually producing azo or hydrazone dyes CIBA-GEIGY AG (CH) 1988-06-22 — — EP claimed
EP-0272212-B1 PROCESS FOR CONTINUALLY PRODUCING AZO OR HYDRAZONE DYES CIBA-GEIGY AG (CH) 1993-09-01 — — EP disclosed
US-4925926-A Preparation of cationic azo or hydrazone dyes in which the alkylation and the separation of the cationic dye are carried out continuously CIBA-GEIGY CORPORATION (US) 1990-05-15 — — US disclosed
EP-0272212-A2 Process for continually producing azo or hydrazone dyes CIBA-GEIGY AG (CH) 1988-06-22 — — EP disclosed
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