SCHEMBL9259113

SCHEMBL9259113

Oc1cccc2[nH]cc(Cc3ccccc3)c12

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.64
KMT2A Q03164 2/20 0.64
GAA P10253 2/20 0.64
KDM4E B2RXH2 1/20 0.64
ALDH1A1 P00352 1/20 0.64
POLB P06746 1/20 0.64
MAPT P10636 1/20 0.64
THRB P10828 1/20 0.64
DNMT1 P26358 1/20 0.64
RECQL P46063 1/20 0.64
CASP6 P55212 1/20 0.64
MCL1 Q07820 1/20 0.64
TDP1 Q9NUW8 1/20 0.64
L3MBTL1 Q9Y468 1/20 0.64
HTR2A P28223 9/20 0.62
HTR2C P28335 7/20 0.61
HTR2B P41595 6/20 0.59
NPSR1 Q6W5P4 1/20 0.58
HTR1A P08908 2/20 0.56
DRD1 P21728 1/20 0.56

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
SCHEMBL1728227 0.87 HTR2C (0.67) MEN1KMT2AGAAKDM4EALDH1A1
SCHEMBL1138149 0.82 SLC5A2 (0.54) MEN1KMT2AGAAKDM4EALDH1A1
SCHEMBL28440788 0.81 MEN1 (0.53) MEN1KMT2AGAAKDM4EALDH1A1
SCHEMBL25008617 0.81 HTR2A (0.68) MEN1KMT2AGAAKDM4EALDH1A1
SCHEMBL25008707 0.79 HTR2A (0.66) MEN1KMT2AGAAKDM4EALDH1A1
SCHEMBL26965662 0.79 HTR2A (0.71) MEN1KMT2AGAAKDM4EALDH1A1
SCHEMBL20898137 0.79 HTR2C (0.65) MEN1KMT2AGAAKDM4EALDH1A1
SCHEMBL8913458 0.79 HTR2A (0.68) MEN1KMT2AGAAKDM4EALDH1A1
SCHEMBL9664075 0.79 HTR2C (0.75) MEN1KMT2AGAAKDM4EALDH1A1
SCHEMBL26965675 0.79 HTR2C (0.65) MEN1KMT2AGAAKDM4EALDH1A1

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-5455262-A Treating arthritis, tumor metastasis, periodontal disease, corneal ulceration, bone resorption diseases, glomerular diseases FLORIDA STATE UNIVERSITY (US) 1995-10-03 US disclosed