SCHEMBL8936362

SCHEMBL8936362

CCCCCCCCCCCCCCCCCCC(=O)Cc1cccc(O)c1

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ DRD2 P14416 2/20 0.49
▸ OPRM1 P35372 2/20 0.49
▸ DRD3 P35462 2/20 0.49
▸ OPRD1 P41143 2/20 0.49
▸ OPRK1 P41145 2/20 0.49
▸ HDAC6 Q9UBN7 1/20 0.49
▸ HTT P42858 2/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ ATM Q13315 1/20 0.47
▸ CTBP2 P56545 1/20 0.45
▸ HSD17B3 P37058 2/20 0.45

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
SCHEMBL8936375 0.98 DRD2 (0.48) MEN1KMT2ADRD2OPRM1DRD3
SCHEMBL8936435 0.94 CTBP2 (0.47) DRD2OPRM1DRD3OPRD1OPRK1
SCHEMBL14041753 0.84 HDAC3 (0.49) MEN1KMT2AHDAC6HTTALDH1A1
SCHEMBL27662921 0.83 PTGS2 (0.56) MEN1KMT2AMAPTHSD17B3
SCHEMBL5703600 0.83 PTGS2 (0.56) MEN1KMT2AMAPTHSD17B3
SCHEMBL5703638 0.83 PTGS2 (0.56) MEN1KMT2AMAPTHSD17B3
SCHEMBL27682616 0.83 PTGS2 (0.56) MEN1KMT2AMAPTHSD17B3
SCHEMBL27682613 0.83 PTGS2 (0.56) MEN1KMT2AMAPTHSD17B3
SCHEMBL8084828 0.82 KMT2A (0.66) MEN1KMT2AALDH1A1MAPT
SCHEMBL7034273 0.82 KMT2A (0.66) MEN1KMT2AALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5512059-A DYEING POLYUREHTANE ELASTIC FIBERS INCLUDING CHLORINE-INDUCED DEGRADATION INHIBITORS THAT DO NO ELUTE OUT TOYO BOSEKI KABUSHIKI KAISHA (JP) 1996-04-30 — — US disclosed
US-5456960-A A multicomponent yarn comprising a polyurethane elastic fiber containing one or more chlorination resistant inhibitors selected from the group consisting of oxides and hydroxides of magnesium, zinc, aluminum and hydrotalcite TOYO BOSEKI KABUSHIHI KAISHA (JP) 1995-10-10 — — US disclosed
EP-0489395-B1 Dyed mixed knit fabric and method for its manufacture TOYO BOSEKI (JP) 1995-09-27 — — EP disclosed
EP-0489395-A1 Dyed mixed knit fabric and method for its manufacture Toyo Boseki Kabushiki Kaisha (JP) 1992-06-10 — — EP disclosed
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