SCHEMBL8654596

SCHEMBL8654596

O=C(Nc1cccc(C(=O)O)c1O)OC1CCCCC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 1/20 0.52
▸ MGLL Q99685 1/20 0.52
▸ NPC1 O15118 1/20 0.47
▸ POLB P06746 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ CYP1A2 P05177 1/20 0.47
▸ CYP3A4 P08684 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ CHRM3 P20309 4/20 0.45
▸ HDAC1 Q13547 2/20 0.44
▸ HDAC2 Q92769 2/20 0.44
▸ ABCC1 P33527 2/20 0.43
▸ CASR P41180 1/20 0.42
▸ HDAC3 O15379 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
SCHEMBL8654299 0.99 FAAH (0.50) FAAHMGLLNPC1POLBRAB9A
SCHEMBL9149617 0.87 KDM4E (0.45) FAAHMGLLSMN1; SMN2KDM4EALDH1A1
SCHEMBL8657522 0.81 FAAH (0.52) FAAHMGLLNPC1POLBRAB9A
SCHEMBL8655878 0.80 FAAH (0.50) FAAHMGLLNPC1POLBRAB9A
SCHEMBL9150838 0.79 HDAC3 (0.47) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL11193941 0.79 KMT2A (0.56) FAAHMGLLNPC1POLBRAB9A
SCHEMBL9150831 0.78 ACMSD (0.44) POLBRAB9AMEN1CYP1A2KMT2A
SCHEMBL11729880 0.77 ALDH1A1 (0.57) KMT2ASMN1; SMN2KDM4EALDH1A1LMNA
SCHEMBL9125441 0.77 FAAH (0.50) FAAHMGLLNPC1POLBRAB9A
SCHEMBL8652549 0.76 KDM4E (0.56) NPC1POLBRAB9AMEN1CYP1A2

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-0630758-B1 Heat-sensitive recording material MITSUBISHI PAPER MILLS LTD (JP) 1998-10-07 — — EP disclosed
US-5466655-A STORAGE STABILITY MITSUBISHI PAPER MILLS LIMITED (JP) 1995-11-14 — — US disclosed
EP-0630758-A2 Heat-sensitive recording material MITSUBISHI PAPER MILLS, LTD. (JP) 1994-12-28 — — EP disclosed
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