SCHEMBL10784602

SCHEMBL10784602

CCN(CCC(=O)OCc1ccccc1)c1cccc(C)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.47
▸ MEN1 O00255 4/20 0.47
▸ KMT2A Q03164 4/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ LMNA P02545 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ RAB9A P51151 3/20 0.43
▸ NPC1 O15118 2/20 0.43
▸ JAK2 O60674 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ PAX8 Q06710 1/20 0.43
▸ GFER P55789 1/20 0.43
▸ PPARG P37231 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ THRA P10827 1/20 0.42
▸ THRB P10828 1/20 0.42
▸ MAPT P10636 2/20 0.41
▸ HSP90AA1 P07900 1/20 0.41

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
SCHEMBL10788300 0.88 ALDH1A1 (0.45) ALDH1A1MEN1KMT2AKDM4ENPSR1
SCHEMBL11506912 0.87 SMN1; SMN2 (0.50) ALDH1A1MEN1KMT2AKDM4ENPSR1
SCHEMBL909147 0.83 GFER (0.44) ALDH1A1MEN1KMT2ANPSR1LMNA
SCHEMBL11417448 0.82 GFER (0.51) ALDH1A1MEN1KMT2AKDM4ENPSR1
SCHEMBL9654341 0.82 SMN1; SMN2 (0.52) ALDH1A1MEN1KMT2ALMNASMN1; SMN2
SCHEMBL8055680 0.81 GFER (0.44) ALDH1A1MEN1KMT2AKDM4ENPSR1
SCHEMBL8048343 0.81 GFER (0.44) ALDH1A1MEN1KMT2AKDM4ENPSR1
SCHEMBL8038475 0.81 GFER (0.46) ALDH1A1MEN1KMT2AKDM4ENPSR1
SCHEMBL397442 0.80 GFER (0.54) ALDH1A1MEN1KMT2AKDM4ENPSR1
SCHEMBL1252550 0.80 MAPT (0.50) ALDH1A1MEN1KMT2ANPSR1LMNA

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-0109857-B1 MONOAZO DYE FOR SYNTHETIC FIBERS RESEARCH ASSOCIATION OF SYNTHETIC DYESTUFFS (JP) 1987-02-11 — — EP disclosed
US-4564673-A 3-Cyano-5-nitrothiophene anilino monoazo dye for synthetic fibers RESEARCH ASSOCIATION OF SYNTHETIC DYESTUFFS (JP) 1986-01-14 — — US disclosed
EP-0109857-A1 Monoazo dye for synthetic fibers RESEARCH ASSOCIATION OF SYNTHETIC DYESTUFFS (JP) 1984-05-30 — — EP disclosed
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