SCHEMBL13615739

SCHEMBL13615739

c1coc(-c2ccc3c4ccccc4c4c5cc(-c6ccco6)ccc5c5ccccc5c4c3c2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.46
ALK Q9UM73 1/20 0.44
ERN1 O75460 1/20 0.42
MMP2 P08253 3/20 0.42
MMP13 P45452 2/20 0.42
PGR P06401 1/20 0.41
KEAP1 Q14145 1/20 0.41
PIM1 P11309 1/20 0.41
PRMT6 Q96LA8 1/20 0.39
MMP9 P14780 1/20 0.39
MMP8 P22894 1/20 0.39
NR4A2 P43354 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
ESR1 P03372 1/20 0.39
POLB P06746 1/20 0.39
HTT P42858 1/20 0.39
KMT2A Q03164 1/20 0.39
HDAC2 Q92769 1/20 0.38
PIK3R1 P27986 1/20 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
SCHEMBL13615894 1.00 TAAR1 (0.46) TAAR1ALKERN1MMP2MMP13
SCHEMBL13615926 1.00 TAAR1 (0.46) TAAR1ALKERN1MMP2MMP13
SCHEMBL13615852 0.94 TAAR1 (0.50) TAAR1ALKERN1PGRKEAP1
SCHEMBL16985946 0.80 PGR (0.46) TAAR1ALKERN1PGRKDM4E
SCHEMBL13629794 0.80 HTR2C (0.36) TAAR1ALKERN1MMP2MMP13
SCHEMBL20324679 0.75 PGR (0.50) TAAR1ALKERN1PGRKDM4E
SCHEMBL20324685 0.75 AHR (0.49) TAAR1ALKERN1PGRKDM4E
SCHEMBL29503092 0.74 CTSV (0.53) TAAR1MMP2MMP13MMP9MMP8
SCHEMBL20324680 0.74 GPR3 (0.47) TAAR1ALKERN1PGRKEAP1
SCHEMBL20324686 0.74 ALDH1A1 (0.47) TAAR1ALKERN1PGRKEAP1

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
US-20090273278-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2009-11-05 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090273278-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same OCIAD1, OCIAD2, ORMDL3 TAAR1 3098/4885ALK 1571/4885ERN1 2042/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.