SCHEMBL30587491

SCHEMBL30587491

Clc1nc(Cl)c(/C=N\Nc2ccccn2)c(Cl)n1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.60
RAB9A P51151 9/20 0.60
NPC1 O15118 6/20 0.60
GAA P10253 6/20 0.60
LMNA P02545 4/20 0.60
L3MBTL1 Q9Y468 3/20 0.60
CYP1A2 P05177 1/20 0.55
CYP3A4 P08684 1/20 0.55
KDM4E B2RXH2 2/20 0.53
MAPT P10636 5/20 0.52
MAPK1 P28482 1/20 0.52
CASP3 P42574 1/20 0.52
SENP7 Q9BQF6 1/20 0.52
SENP6 Q9GZR1 1/20 0.52
MEN1 O00255 5/20 0.51
KMT2A Q03164 5/20 0.51
TDP1 Q9NUW8 2/20 0.51
ALDH1A1 P00352 1/20 0.51
NCOA1 Q15788 1/20 0.48
NCOA3 Q9Y6Q9 1/20 0.48

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
SCHEMBL27128736 0.82 RAB9A (0.61) SMN1; SMN2RAB9ANPC1GAALMNA
SCHEMBL24267831 0.82 RAB9A (0.61) SMN1; SMN2RAB9ANPC1GAALMNA
SCHEMBL11304288 0.79 RAB9A (0.69) SMN1; SMN2RAB9ANPC1GAALMNA
SCHEMBL11304285 0.79 RAB9A (0.69) SMN1; SMN2RAB9ANPC1GAALMNA
SCHEMBL31706205 0.78 MAPT (0.53) SMN1; SMN2RAB9ANPC1GAALMNA
SCHEMBL4180835 0.75 RAB9A (1.00) SMN1; SMN2RAB9ANPC1GAALMNA
SCHEMBL4180837 0.75 RAB9A (1.00) SMN1; SMN2RAB9ANPC1GAALMNA
SCHEMBL9735520 0.75 RAB9A (0.58) SMN1; SMN2RAB9ANPC1GAALMNA
SCHEMBL5051613 0.74 PAX8 (0.65) SMN1; SMN2RAB9ANPC1GAALMNA
SCHEMBL7522459 0.74 RAB9A (0.76) SMN1; SMN2RAB9ANPC1GAALMNA

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
CN-111269221-B Bicyclic lactams and methods of use thereof 豪夫迈·罗氏有限公司 2023-09-26 CN disclosed