SCHEMBL9308216

SCHEMBL9308216

O=C(O)C1CCCN1C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.44
ALDH1A1 P00352 8/20 0.44
KDM4E B2RXH2 4/20 0.44
RAB9A P51151 1/20 0.44
HPGD P15428 2/20 0.43
CA2 P00918 1/20 0.42
TSHR P16473 1/20 0.42
L3MBTL1 Q9Y468 3/20 0.42
POLB P06746 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
MCL1 Q07820 1/20 0.42
FTO Q9C0B1 1/20 0.41
ALOX12 P18054 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
GYS1 P13807 1/20 0.40

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
SCHEMBL9310967 0.84 ALDH1A1 (0.46) MAPTALDH1A1KDM4EHPGDL3MBTL1
SCHEMBL9307737 0.81 ALDH1A1 (0.41) MAPTALDH1A1KDM4ERAB9AHPGD
SCHEMBL9309145 0.81 ALDH1A1 (0.41) MAPTALDH1A1KDM4ERAB9AHPGD
SCHEMBL9309310 0.81 ALDH1A1 (0.41) MAPTALDH1A1KDM4ERAB9AHPGD
SCHEMBL9307727 0.81 ALDH1A1 (0.41) MAPTALDH1A1KDM4ERAB9AHPGD
SCHEMBL1446429 0.77 MAPT (0.57) MAPTALDH1A1KDM4ERAB9AL3MBTL1
SCHEMBL9308869 0.75 ALDH1A1 (0.58) ALDH1A1HPGDCA2TSHRL3MBTL1
SCHEMBL9309024 0.74 MAPT (0.42) MAPTALDH1A1KDM4ERAB9AHPGD
SCHEMBL14894965 0.73 SMN1; SMN2 (0.49) MAPTALDH1A1CA2L3MBTL1FTO
SCHEMBL14894966 0.73 SMN1; SMN2 (0.49) MAPTALDH1A1CA2L3MBTL1FTO

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
US-5332735-A Antiamnesic activity ADIR ET COMPAGNIE (FR) 1994-07-26 US disclosed