SCHEMBL8628781

SCHEMBL8628781

COc1cccc2c1OCC(C=O)=C2

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.53
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
MAPT P10636 2/20 0.49
POLB P06746 1/20 0.49
HTT P42858 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
NR1H4 Q96RI1 1/20 0.48
TP53 P04637 2/20 0.46
MEN1 O00255 2/20 0.45
ALDH1A1 P00352 1/20 0.44
CA12 O43570 1/20 0.42
CA9 Q16790 1/20 0.42
TLR2 O60603 1/20 0.41
ERN1 O75460 1/20 0.41
TLR1 Q15399 1/20 0.41
TLR6 Q9Y2C9 1/20 0.41
PTGS1 P23219 1/20 0.39
PTGS2 P35354 1/20 0.39
MAOB P27338 2/20 0.38

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
SCHEMBL31546944 1.00 KMT2A (0.53) KMT2ANPC1RAB9AMAPTPOLB
SCHEMBL31546772 0.82 KMT2A (0.51) KMT2ANPC1RAB9AMAPTPOLB
SCHEMBL9163457 0.81 LMNA (0.47) KMT2ANPC1RAB9AMAPTPOLB
SCHEMBL266610 0.78 KMT2A (0.55) KMT2ANPC1RAB9AMAPTPOLB
SCHEMBL30524337 0.78 KMT2A (0.55) KMT2ANPC1RAB9AMAPTPOLB
SCHEMBL9160839 0.77 KMT2A (0.49) KMT2ANPC1RAB9AMAPTPOLB
SCHEMBL9160820 0.77 KMT2A (0.49) KMT2ANPC1RAB9AMAPTPOLB
SCHEMBL29444142 0.76 KMT2A (0.53) KMT2ANPC1RAB9AMAPTPOLB
SCHEMBL9058215 0.75 KMT2A (0.70) KMT2ANPC1RAB9AMAPTPOLB
SCHEMBL981963 0.75 KMT2A (0.70) KMT2ANPC1RAB9AMAPTPOLB

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-5717106-A THERMAL DYE TRANSFER IMAGING EASTMAN KODAK COMPANY (US) 1998-02-10 US disclosed
US-5712223-A YELLOW DYES WITH IMPROVED EFFICIENCY EASTMAN KODAK COMPANY (US) 1998-01-27 US disclosed