SCHEMBL31294902

SCHEMBL31294902

c1ccc2cc(-n3cnc4ccccc43)ccc2c1

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.62
FGFR1 P11362 6/20 0.60
NR1I2 O75469 1/20 0.53

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
SCHEMBL16158486 0.85 FGFR1 (0.59) HTTFGFR1
SCHEMBL3419279 0.83 HTT (0.88) HTTFGFR1
SCHEMBL30402227 0.83 HTT (0.88) HTTFGFR1
SCHEMBL3417304 0.82 HTT (0.78) HTTFGFR1
SCHEMBL13052913 0.81 HTT (0.77) HTTFGFR1
SCHEMBL14019115 0.79 FGFR1 (0.60) HTTFGFR1
SCHEMBL13045093 0.79 FGFR1 (0.52) HTTFGFR1NR1I2
SCHEMBL23000896 0.79 GABRP (0.70) HTTFGFR1
SCHEMBL2531256 0.78 HTT (0.78) HTTFGFR1
SCHEMBL22843347 0.78 HTT (0.61) HTTFGFR1

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-119118844-A Method for preparing N-phenyl phenylenediamine compound by structural reforming of imidazole compound 中国科学院兰州化学物理研究所 2024-12-13 CN disclosed