SCHEMBL11310770

SCHEMBL11310770

Cc1cccc(N(CCOC(=O)CCCl)CCOC(=O)CCCl)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 5/20 0.42
▸ ALDH1A1 P00352 4/20 0.42
▸ NPC1 O15118 3/20 0.42
▸ PAX8 Q06710 2/20 0.42
▸ TP53 P04637 1/20 0.42
▸ GPX4 P36969 1/20 0.42
▸ HTT P42858 2/20 0.41
▸ JAK2 O60674 1/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ LMNA P02545 3/20 0.39
▸ RXRA P19793 1/20 0.38
▸ RXRB P28702 1/20 0.38
▸ RXRG P48443 1/20 0.38
▸ CDYL Q9Y232 1/20 0.38
▸ MAPT P10636 2/20 0.38
▸ GFER P55789 1/20 0.37
▸ PPARG P37231 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ MAPK1 P28482 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
SCHEMBL11745632 0.94 GFER (0.44) RAB9AALDH1A1NPC1PAX8TP53
SCHEMBL8055680 0.83 GFER (0.44) RAB9AALDH1A1NPC1PAX8TP53
SCHEMBL10119047 0.83 TDP1 (0.46) RAB9AALDH1A1NPC1HTTSMN1; SMN2
SCHEMBL8020755 0.81 LMNA (0.44) RAB9AALDH1A1NPC1PAX8TP53
SCHEMBL29833608 0.81 LMNA (0.44) RAB9AALDH1A1NPC1PAX8TP53
SCHEMBL8048316 0.81 MAPT (0.47) RAB9AALDH1A1NPC1PAX8TP53
SCHEMBL9654341 0.80 SMN1; SMN2 (0.52) RAB9AALDH1A1NPC1PAX8TP53
SCHEMBL11671513 0.80 ALDH1A1 (0.44) RAB9AALDH1A1NPC1PAX8TP53
SCHEMBL8038475 0.80 GFER (0.46) RAB9AALDH1A1NPC1PAX8TP53
SCHEMBL28665502 0.80 GFER (0.47) RAB9AALDH1A1NPC1PAX8TP53

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
JP-56151764-A — — None — — JP disclosed
JP-S56151764-A MONOAZO DYE FOR SYNTHETIC FIBER MITSUBISHI CHEM IND LTD 1981-11-24 — — JP disclosed
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