SCHEMBL9255441

SCHEMBL9255441

O=C1CCc2nc3ccccc3n21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.53
HPGD P15428 2/20 0.53
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
NOTUM Q6P988 1/20 0.47
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 4/20 0.44
MAPK1 P28482 2/20 0.44
MAPT P10636 4/20 0.43
HSD17B10 Q99714 3/20 0.43
ALOX15 P16050 2/20 0.43
TSHR P16473 2/20 0.42
LMNA P02545 3/20 0.41
STAT3 P40763 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
HTT P42858 1/20 0.41
KDM4E B2RXH2 2/20 0.39
USP2 O75604 2/20 0.39
CYP1A2 P05177 1/20 0.39

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
SCHEMBL7484548 0.89 ALDH1A1 (0.50) ALDH1A1HPGDMEN1KMT2ANOTUM
SCHEMBL22801901 0.81 ALDH1A1 (0.43) ALDH1A1HPGDMEN1KMT2ANOTUM
SCHEMBL30525520 0.76 HPGD (0.37) ALDH1A1HPGDMEN1KMT2ANOTUM
SCHEMBL24329594 0.76 SMN1; SMN2 (0.44) ALDH1A1NOTUMRAB9ASMN1; SMN2MAPK1
SCHEMBL24329970 0.76 HPGD (0.37) ALDH1A1HPGDMEN1KMT2ANOTUM
SCHEMBL7477785 0.74 LMNA (0.42) ALDH1A1HPGDMEN1KMT2ARAB9A
SCHEMBL17910548 0.73 ALDH1A1 (0.47) ALDH1A1HPGDMEN1KMT2ARAB9A
Bromide SCHEMBL8073581 0.73 LMNA (0.41) ALDH1A1HPGDMEN1KMT2ARAB9A
SCHEMBL22801900 0.72 KMT2A (0.42) ALDH1A1HPGDMEN1KMT2ASMN1; SMN2
SCHEMBL17531765 0.72 MAPT (0.43) ALDH1A1MEN1KMT2ARAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5428043-A Tricyclic-cyclic amines as novel cholinesterase inhibitors PFIZER INC. (US) 1995-06-27 US disclosed
EP-0441517-A2 Tricyclic amines as novel cholinesterase inhibitors PFIZER INC. (US) 1991-08-14 EP disclosed