SCHEMBL14301005

SCHEMBL14301005

Bc1cc(C)c(OCC(O)CN)c(C)c1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.61
KMT2A Q03164 4/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
ALOX15 P16050 1/20 0.47
SCN4A P35499 4/20 0.46
MAPT P10636 2/20 0.44
GLA P06280 1/20 0.44
LMNA P02545 2/20 0.40
S1PR1 P21453 1/20 0.40
MEN1 O00255 3/20 0.39
GAA P10253 2/20 0.39
HPGD P15428 1/20 0.39
HTT P42858 1/20 0.39
ALDH1A1 P00352 1/20 0.39
POLB P06746 1/20 0.38
MAPK1 P28482 1/20 0.38
CYP2D6 P10635 1/20 0.38
NR2E1 Q9Y466 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
SCHEMBL767862 0.86 TSHR (0.65) TSHRKMT2ASMN1; SMN2ALOX15SCN4A
SCHEMBL767863 0.86 TSHR (0.65) TSHRKMT2ASMN1; SMN2ALOX15SCN4A
SCHEMBL14306154 0.84 TSHR (0.63) TSHRKMT2ASMN1; SMN2ALOX15SCN4A
SCHEMBL14301111 0.84 TSHR (0.63) TSHRKMT2ASMN1; SMN2ALOX15SCN4A
SCHEMBL772928 0.83 TSHR (0.61) TSHRKMT2ASMN1; SMN2ALOX15SCN4A
SCHEMBL772838 0.83 SCN4A (0.68) TSHRKMT2ASMN1; SMN2ALOX15SCN4A
SCHEMBL773113 0.79 TSHR (0.60) TSHRKMT2ASMN1; SMN2ALOX15SCN4A
SCHEMBL773062 0.79 TSHR (0.93) TSHRKMT2ASMN1; SMN2ALOX15SCN4A
SCHEMBL23837136 0.74 LMNA (0.39) TSHRKMT2ASMN1; SMN2SCN4AMAPT
SCHEMBL772851 0.74 TSHR (0.68) TSHRKMT2ASMN1; SMN2ALOX15SCN4A

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-2008021369-A2 TRICYCLIC COMPOUNDS AND ITS USE AS TYROSINE KINASE MODULATORS CHEMBRIDGE RESEARCH LABORATORIES, INC. (US) 2008-02-21 WO disclosed