SCHEMBL18780368

SCHEMBL18780368

O=C(Oc1ccc(C2(c3ccccc3)CCCCC2)cc1)c1ccc(Oc2ccccc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.48
ALDH1A1 P00352 4/20 0.48
MEN1 O00255 3/20 0.47
PARP10 Q53GL7 2/20 0.47
ADORA3 P0DMS8 1/20 0.46
SLC6A2 P23975 1/20 0.45
SLC6A4 P31645 1/20 0.45
SLC6A3 Q01959 1/20 0.45
SMN1; SMN2 Q16637 3/20 0.43
PRSS1 P07477 1/20 0.43
ACR P10323 1/20 0.43
TMPRSS15 P98073 1/20 0.43
SRD5A2 P31213 1/20 0.42
MAPT P10636 3/20 0.41
TDP1 Q9NUW8 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
PKM P14618 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
SCHEMBL9561801 0.90 KMT2A (0.56) KMT2AALDH1A1MEN1PARP10ADORA3
SCHEMBL12337416 0.85 ESR1 (0.56) KMT2AALDH1A1MEN1PARP10ADORA3
SCHEMBL2718813 0.84 KMT2A (0.50) KMT2AALDH1A1MEN1PARP10ADORA3
SCHEMBL13779474 0.84 ELANE (0.53) KMT2AALDH1A1MEN1PARP10ADORA3
SCHEMBL26728699 0.83 ADORA3 (0.47) KMT2AALDH1A1MEN1PARP10ADORA3
SCHEMBL14580087 0.82 LMNA (0.50) KMT2AALDH1A1MEN1PARP10SLC6A2
SCHEMBL25969504 0.82 ESR1 (0.50) ALDH1A1ADORA3SMN1; SMN2MAPTL3MBTL1
SCHEMBL12404396 0.82 MAPT (0.46) KMT2AALDH1A1PARP10ADORA3SMN1; SMN2
SCHEMBL12376960 0.82 MAPT (0.46) KMT2AALDH1A1PARP10ADORA3SMN1; SMN2
SCHEMBL13030420 0.82 TDP1 (0.49) KMT2AALDH1A1MEN1ADORA3SLC6A2

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
EP-2633370-B1 ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER, PROCESS CARTRIDGE, AND ELECTROPHOTOGRAPHIC APPARATUS CANON KK (JP) 2017-04-26 EP disclosed