SCHEMBL31187352

SCHEMBL31187352

CN[C@@H]1C[C@H]1c1ccc(NC(=O)c2ccc(Br)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 11/20 0.51
MAOA P21397 9/20 0.51
MAOB P27338 9/20 0.51
RCOR1 Q9UKL0 3/20 0.50
KMT2A Q03164 3/20 0.50
MEN1 O00255 2/20 0.50
KDM1B Q8NB78 1/20 0.50
KDM4E B2RXH2 1/20 0.49
ALDH1A1 P00352 1/20 0.49
PLEC Q15149 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
USP2 O75604 1/20 0.49

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
SCHEMBL31187350 0.87 KDM1A (0.49) KDM1AMAOAMAOBRCOR1KDM1B
SCHEMBL31187376 0.87 SMN1; SMN2 (0.54) KDM1AMAOAMAOBRCOR1KMT2A
SCHEMBL21101344 0.86 KDM1A (0.68) KDM1AMAOAMAOBRCOR1KMT2A
SCHEMBL31187354 0.84 KMT2A (0.52) KDM1AMAOAMAOBRCOR1KMT2A
SCHEMBL31187374 0.82 MAOA (0.74) KDM1AMAOAMAOBRCOR1KDM1B
SCHEMBL31187349 0.80 MAOA (0.49) KDM1AMAOAMAOBRCOR1KMT2A
SCHEMBL31187356 0.79 KDM1A (0.52) KDM1AMAOAMAOB
SCHEMBL31187353 0.79 MAOA (0.48) KDM1AMAOAMAOBRCOR1KMT2A
Hydrochloric Acid SCHEMBL4133963 0.79 KDM1A (0.53) KDM1AMAOAMAOBRCOR1KDM1B
SCHEMBL21798720 0.77 KMT2A (0.76) KMT2AMEN1KDM4EUSP2

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-118908915-A Cyclopropylamine compound, preparation method thereof and application thereof in antiviral aspect 中国医学科学院医药生物技术研究所 2024-11-08 CN disclosed