SCHEMBL7968663

SCHEMBL7968663

COc1ccccc1CC(=O)c1c(O)cc(C)oc1=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 1/20 0.53
KMT2A Q03164 11/20 0.53
MEN1 O00255 10/20 0.53
MAPT P10636 4/20 0.53
RAB9A P51151 4/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
PLIN1 O60240 1/20 0.53
POLB P06746 1/20 0.53
ALOX12 P18054 1/20 0.53
PLIN5 Q00G26 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
ABHD5 Q8WTS1 1/20 0.53
KDM4E B2RXH2 2/20 0.49
NPC1 O15118 3/20 0.48
PKM P14618 1/20 0.48
GAA P10253 3/20 0.48
HTT P42858 1/20 0.48
RECQL P46063 1/20 0.48
ELANE P08246 2/20 0.48
ALDH1A1 P00352 1/20 0.46

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
SCHEMBL7957668 0.78 MEN1 (0.47) KMT2AMEN1MAPTRAB9ASMN1; SMN2
SCHEMBL7950033 0.74 ELANE (0.56) KMT2AMEN1MAPTRAB9ASMN1; SMN2
SCHEMBL23146904 0.74 ELANE (0.58) KMT2AMEN1MAPTRAB9ASMN1; SMN2
SCHEMBL7960609 0.72 ESR1 (0.55) KMT2AMEN1MAPTRAB9ASMN1; SMN2
SCHEMBL7958244 0.72 ELANE (0.57) KMT2AMEN1MAPTRAB9APOLB
SCHEMBL6026933 0.72 ELANE (0.68) KMT2AMEN1RAB9ASMN1; SMN2POLB
SCHEMBL7950013 0.71 ELANE (0.52) KMT2AMEN1MAPTRAB9ASMN1; SMN2
SCHEMBL458844 0.71 GAA (0.60) TTRKMT2AMEN1MAPTRAB9A
SCHEMBL29150900 0.71 NFKB1 (0.67) TTRKMT2AMEN1MAPTRAB9A
SCHEMBL5202614 0.71 MAPT (0.59) KMT2AMEN1MAPTSMN1; SMN2POLB

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-6215016-B1 HEMATOPOIETIC AGENTS; PREVENTING CYTOPENIA TORAY INDUSTRIES, INC. (JP) 2001-04-10 US disclosed
EP-0841063-A1 KETONE DERIVATIVES AND MEDICINAL USE THEREOF TORAY INDUSTRIES, INC. (JP) 1998-05-13 EP disclosed