SCHEMBL23338337

SCHEMBL23338337

Clc1ccc(C2CC3CCC2C3)cc1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.56
MEN1 O00255 1/20 0.56
GAA P10253 1/20 0.56
KMT2A Q03164 1/20 0.56
HSP90AA1 P07900 1/20 0.45
HTR2A P28223 1/20 0.43
HTR2C P28335 1/20 0.43
HTR2B P41595 1/20 0.43
SLC6A3 Q01959 6/20 0.41
SLC6A4 P31645 4/20 0.41
CYP19A1 P11511 1/20 0.41
MDM2 Q00987 1/20 0.40

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
SCHEMBL30501155 1.00 POLB (0.56) POLBMEN1GAAKMT2AHSP90AA1
SCHEMBL25644786 0.94 MEN1 (0.51) POLBMEN1GAAKMT2AHSP90AA1
SCHEMBL900460 0.89 MEN1 (0.66) POLBMEN1GAAKMT2ASLC6A3
SCHEMBL3049400 0.80 GAA (0.66) POLBMEN1GAAKMT2ASLC6A3
SCHEMBL21409728 0.80 MEN1 (0.56) POLBMEN1GAAKMT2ASLC6A3
SCHEMBL25171587 0.80 MEN1 (0.56) POLBMEN1GAAKMT2AHSP90AA1
SCHEMBL6053773 0.79 SLC6A3 (0.57) POLBMEN1GAAKMT2AHTR2A
SCHEMBL8673153 0.79 SLC6A3 (0.57) POLBMEN1GAAKMT2AHTR2A
SCHEMBL26143494 0.78 MEN1 (0.54) POLBMEN1GAAKMT2ASLC6A3
SCHEMBL25732993 0.77 KDM1A (0.53) POLBMEN1GAAKMT2ASLC6A3

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
WO-2021082714-A1 NITROGEN-CONTAINING COMPOUND, ELECTRONIC COMPONENT AND ELECTRONIC DEVICE 陕西莱特光电材料股份有限公司 2021-05-06 WO disclosed