SCHEMBL27600620

SCHEMBL27600620

O=Cc1cncc2ccccc12.[H+]

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 8/20 0.49
TDP1 Q9NUW8 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
LMNA P02545 1/20 0.41
THRB P10828 1/20 0.41
BLM P54132 1/20 0.41
PRKCZ Q05513 1/20 0.41
ADRA2A P08913 1/20 0.40
ADRA2B P18089 1/20 0.40
ADRA2C P18825 1/20 0.40
ADRA1A P35348 1/20 0.40
AURKA O14965 1/20 0.39
ERBB2 P04626 1/20 0.39
KDR P35968 1/20 0.39
CYP2A6 P11509 2/20 0.37
ALDH1A1 P00352 1/20 0.37
PARP1 P09874 1/20 0.37
PRKCI P41743 1/20 0.37
PDE4B Q07343 1/20 0.37

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
SCHEMBL29956340 0.98 ERN1 (0.50) ERN1TDP1MEN1KMT2ALMNA
SCHEMBL1351597 0.98 ERN1 (0.50) ERN1TDP1MEN1KMT2ALMNA
Bromide SCHEMBL8728642 0.96 ERN1 (0.49) ERN1TDP1MEN1KMT2ALMNA
SCHEMBL6655165 0.79 AURKA (0.45) ERN1MEN1KMT2ALMNAPRKCZ
SCHEMBL6655162 0.79 AURKA (0.45) ERN1MEN1KMT2ALMNAPRKCZ
SCHEMBL587500 0.79 ERN1 (0.50) ERN1KMT2ALMNACYP2A6ALDH1A1
SCHEMBL2474264 0.78 ERN1 (0.55) ERN1TDP1MEN1KMT2ALMNA
SCHEMBL6301827 0.78 AURKA (0.43) ERN1TDP1PRKCZADRA2AADRA2B
SCHEMBL7408413 0.77 KDM4E (0.46) TDP1MEN1KMT2ALMNAALDH1A1
SCHEMBL2011044 0.76 CCNT1 (0.49) ERN1LMNACYP2A6IMPDH2POLB

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
CN-100575345-C 2 type Cannabined receptors are had in conjunction with active Pyridione derivatives SHIONOGI & CO 2009-12-30 CN disclosed
CN-1492856-A Pyridone derivative having affinity for cannabinoid 2-type receptor ��Ұ����ҩ��ʽ���� 2004-04-28 CN disclosed