SCHEMBL8880969

SCHEMBL8880969

C[C@@H](N)C(=O)Nn1cccc1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.38
DPP4 P27487 1/20 0.38
XIAP P98170 6/20 0.36
BIRC2 Q13490 1/20 0.36
CTRB1 P17538 5/20 0.35
IDO1 P14902 2/20 0.35
SLC15A1 P46059 1/20 0.32
LTA4H P09960 1/20 0.31
PKM P14618 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
LARS1 Q9P2J5 1/20 0.30

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
SCHEMBL8879654 1.00 TAAR1 (0.38) TAAR1DPP4XIAPBIRC2CTRB1
SCHEMBL8879521 1.00 TAAR1 (0.38) TAAR1DPP4XIAPBIRC2CTRB1
Hydrochloric Acid SCHEMBL8880539 0.98 TAAR1 (0.37) TAAR1DPP4XIAPBIRC2CTRB1
SCHEMBL8878814 0.75 ESR2 (0.34)
SCHEMBL8878827 0.75 ESR2 (0.34)
Hydrochloric Acid SCHEMBL8880303 0.74 KDM4E (0.36)
SCHEMBL8878956 0.71 TDP1 (0.32)
SCHEMBL5610745 0.69
SCHEMBL1258017 0.69
Hydrochloric Acid SCHEMBL27321584 0.67 LMNA (0.36)

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5605925-A COGNITION ACTIVATOR; ALZHEIMER'S DISEASE HOECHST MARION ROUSSEL, INC. (US) 1997-02-25 US disclosed
US-5580987-A TREATING 1-PHTHALIMIDOPYRROLE WITH BASE TO YIELD 1-AMINOPYRROLE, REACTING WITH SUBSTITUTED AMINO ACID TO OBTAIN DESIRED COMPOUND HOECHST MARION ROUSSEL, INC. (US) 1996-12-03 US disclosed
US-5576446-A GLYCINE PARTIAL AGONIST AND ENHANCEMENT OF LEARNING AND MEMORY, TREATMENT OF ALZHEIMER'S HOECHST MARION ROUSSEL, INC. (US) 1996-11-19 US disclosed
US-5428053-A Treats alzheimer's disease and other senile dementias HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1995-06-27 US disclosed
EP-0582182-A1 1-Aminoacetamidopyrroles and 1-amino-2-(substituted) pyrroles and their use for the treatment of neurodegenerative dysfunctions HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1994-02-09 EP disclosed
US-5274116-A 1-aminoacetamidopyrroles and 1-aminoacetamido-2-(substituted)pyrroles and related compounds HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1993-12-28 US disclosed