SCHEMBL9137406

SCHEMBL9137406

Cc1c(C(c2cccc(O)c2)c2cc(C3CCCCC3)c(O)c(C)c2C)cc(C2CCCCC2)c(O)c1C

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SLC6A4 P31645 1/20 0.40
▸ OPRM1 P35372 1/20 0.40
▸ KDR P35968 1/20 0.40
▸ SLC6A3 Q01959 1/20 0.40
▸ OPRD1 P41143 1/20 0.36
▸ OPRK1 P41145 1/20 0.36
▸ ADRB1 P08588 1/20 0.33
▸ MIF P14174 1/20 0.33
▸ HTR2A P28223 1/20 0.33
▸ ADRA1A P35348 1/20 0.33
▸ HTR2B P41595 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.32
▸ POLB P06746 1/20 0.32

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
SCHEMBL9136544 0.85 KDM4E (0.34) MIF
SCHEMBL30374841 0.82 SLC6A4 (0.40) SLC6A4OPRM1KDRSLC6A3OPRD1
SCHEMBL29373431 0.82 SLC6A4 (0.40) SLC6A4OPRM1KDRSLC6A3OPRD1
SCHEMBL757144 0.82 SLC6A4 (0.40) SLC6A4OPRM1KDRSLC6A3OPRD1
SCHEMBL29484419 0.81 SLC6A4 (0.41) SLC6A4OPRM1KDRSLC6A3OPRD1
SCHEMBL2512539 0.81 SLC6A4 (0.41) SLC6A4OPRM1KDRSLC6A3OPRD1
SCHEMBL29484415 0.81 SLC6A4 (0.41) SLC6A4OPRM1KDRSLC6A3OPRD1
SCHEMBL2516717 0.81 SLC6A4 (0.41) SLC6A4OPRM1KDRSLC6A3OPRD1
SCHEMBL30103811 0.80 SLC6A4 (0.40) SLC6A4OPRM1KDRSLC6A3OPRD1
SCHEMBL28899040 0.80 SLC6A4 (0.40) SLC6A4OPRM1KDRSLC6A3OPRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5401605-A Positive working photosensitive resin composition containing 1,2-naphthoquinone diazide esterification product of triphenylmethane compound TOKYO OHKA KOGYO CO., LTD. (JP) 1995-03-28 — — US disclosed
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