SCHEMBL11138202

SCHEMBL11138202

Cc1cc(C(C)(C)c2ccc(O)cc2)c(C)cc1C(=O)Nc1ccc(C(=O)Cl)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SNCA P37840 1/20 0.42
▸ HDAC6 Q9UBN7 3/20 0.42
▸ HDAC8 Q9BY41 2/20 0.42
▸ HDAC1 Q13547 1/20 0.42
▸ CYP26A1 O43174 1/20 0.42
▸ CYP26B1 Q9NR63 1/20 0.42
▸ NPC1 O15118 3/20 0.41
▸ RAB9A P51151 3/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ TP53 P04637 2/20 0.40
▸ THRB P10828 1/20 0.40
▸ PPARG P37231 1/20 0.40
▸ PPARA Q07869 1/20 0.40
▸ NR1H4 Q96RI1 1/20 0.40
▸ LDLR P01130 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ GFER P55789 1/20 0.40
▸ NQO2 P16083 2/20 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
SCHEMBL11133844 0.89 RAB9A (0.49) HDAC6NPC1RAB9ASMN1; SMN2MEN1
SCHEMBL11144132 0.87 ESRRB (0.46) SNCAHDAC6HDAC8HDAC1CYP26A1
SCHEMBL11138094 0.82 NPC1 (0.55) SNCAHDAC6HDAC8NPC1RAB9A
SCHEMBL11138217 0.80 NR1H4 (0.46) SNCANPC1RAB9ASMN1; SMN2MEN1
SCHEMBL11141910 0.77 ESR1 (0.53) SNCAHDAC6HDAC8NPC1RAB9A
SCHEMBL11136041 0.76 KMT2A (0.51) HDAC6HDAC8HDAC1RAB9AMEN1
SCHEMBL11136963 0.76 RAB9A (0.54) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL11138236 0.75 HDAC3 (0.60) SNCAHDAC6HDAC8NPC1RAB9A
Bisphenol A SCHEMBL7906361 0.73 ESR1 (0.64) POLBGFERESRRBESRRG
SCHEMBL11138232 0.72 KCNK9 (0.57) HDAC6HDAC8NPC1RAB9ASMN1; SMN2

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
US-4387210-A Process for producing aromatic polyester amide MITSUI TOATSU CHEMICAL, INC. (JP) 1983-06-07 — — US disclosed
EP-0055480-A1 Process for producing aromatic polyester amide MITSUI TOATSU CHEMICALS, Inc. (JP) 1982-07-07 — — EP disclosed
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