SCHEMBL31187351

SCHEMBL31187351

N[C@@H]1C[C@H]1c1ccc(NC(=O)c2ccc(Cl)cc2)cc1

nearest known ligand 0.74

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 17/20 0.74
▸ KDM1A O60341 16/20 0.74
▸ MAOB P27338 14/20 0.74
▸ RCOR1 Q9UKL0 10/20 0.74
▸ KDM1B Q8NB78 8/20 0.74

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
SCHEMBL31187359 0.85 MAOA (0.74) MAOAKDM1AMAOBRCOR1KDM1B
SCHEMBL31187347 0.85 KDM1A (0.74) MAOAKDM1AMAOBRCOR1KDM1B
SCHEMBL31187374 0.85 MAOA (0.74) MAOAKDM1AMAOBRCOR1KDM1B
SCHEMBL2557921 0.85 KDM1A (1.00) MAOAKDM1AMAOBRCOR1KDM1B
SCHEMBL21471753 0.85 KDM1A (1.00) MAOAKDM1AMAOBRCOR1KDM1B
SCHEMBL17003579 0.85 MAOA (1.00) MAOAKDM1AMAOBRCOR1KDM1B
SCHEMBL12813993 0.85 KDM1A (1.00) MAOAKDM1AMAOBRCOR1KDM1B
SCHEMBL17003580 0.85 MAOA (1.00) MAOAKDM1AMAOBRCOR1KDM1B
SCHEMBL15944933 0.85 KDM1A (1.00) MAOAKDM1AMAOBRCOR1KDM1B
Hydrochloric Acid SCHEMBL15789127 0.84 KDM1A (1.00) MAOAKDM1AMAOBRCOR1KDM1B

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
Send feedback