SCHEMBL9796154

SCHEMBL9796154

O=Cc1cccn1NC(=O)O

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.44
TRIM24 O15164 1/20 0.44
TRIM33 Q9UPN9 1/20 0.44
KDM4E B2RXH2 1/20 0.36
POLB P06746 2/20 0.35
ALDH1A1 P00352 8/20 0.35
GAA P10253 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CYP2A6 P11509 1/20 0.33
DRD2 P14416 1/20 0.33
DRD4 P21917 1/20 0.33
DRD3 P35462 1/20 0.33
KMT2A Q03164 1/20 0.33
CYP1A2 P05177 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL3178412 0.73 ATM (0.48) ATMTRIM24TRIM33ALDH1A1GAA
SCHEMBL22076913 0.69 ATM (0.48) ATMTRIM24TRIM33POLBALDH1A1
SCHEMBL31273663 0.69 TRIM24 (0.48) ATMTRIM24TRIM33KDM4EPOLB
SCHEMBL28845024 0.69 TRIM24 (0.44) ATMTRIM24TRIM33POLBALDH1A1
SCHEMBL27554082 0.69 ATM (0.44) ATMTRIM24TRIM33DRD2DRD4
Maleic Acid SCHEMBL9469974 0.69 SLC6A2 (0.52) ATMKDM4EALDH1A1KMT2ACYP1A2
SCHEMBL3195414 0.67 TRIM24 (0.46) ATMTRIM24TRIM33KDM4EALDH1A1
SCHEMBL10366987 0.67 ALDH1A1 (0.51) ALDH1A1SMN1; SMN2KMT2ACYP1A2
SCHEMBL14397853 0.67 ATM (0.42) ATMTRIM24TRIM33POLBALDH1A1
SCHEMBL14397828 0.67 ATM (0.46) ATMTRIM24TRIM33POLBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5039687-A Learning enhancement, cognition activation HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1991-08-13 US disclosed
US-4900742-A N-(pyrrol-1-yl)pyridinamine compounds having memory enhancing properties HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) 1990-02-13 US disclosed
US-4752610-A N-(pyrrol-1-yl)pyridinamines having memory enhancing properties HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1988-06-21 US disclosed