SCHEMBL9819485

SCHEMBL9819485

O=C(NCCCC(=O)N1CCCC1)c1cc(Br)no1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.42
CHRNA4 P43681 2/20 0.41
ATM Q13315 1/20 0.41
POLB P06746 1/20 0.40
FPR3 P25089 1/20 0.39
FPR2 P25090 1/20 0.39
RAB9A P51151 1/20 0.38
TRPV1 Q8NER1 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL9819459 0.95 ALDH1A1 (0.40) ALDH1A1CHRNA4ATMPOLBFPR3
SCHEMBL9819529 0.90 POLB (0.40) ALDH1A1CHRNA4POLBKMT2A
SCHEMBL9819432 0.83 LMNA (0.45) ALDH1A1CHRNA4POLBRAB9AKMT2A
SCHEMBL19746834 0.81 USP30 (0.50) ALDH1A1RAB9AKMT2A
SCHEMBL9819468 0.80 LMNA (0.47) ALDH1A1ATMPOLB
SCHEMBL9819528 0.80 POLB (0.47) ALDH1A1CHRNA4POLB
SCHEMBL17661474 0.80 HDAC3 (0.50) ALDH1A1RAB9AKMT2A
SCHEMBL9819406 0.79 LMNA (0.46) ALDH1A1ATMPOLB
SCHEMBL17661480 0.79 HDAC3 (0.49) ALDH1A1RAB9AKMT2A
SCHEMBL9819400 0.78 POLB (0.44) ALDH1A1CHRNA4POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0317588-B1 ISOXAZOLES WITH NOOTROPIC ACTIVITY ZAMBON GROUP S.p.A. (IT) 1991-08-07 EP disclosed
US-4985428-A Isoxazoles with nootropic activity ZAMBON GROUP S.P.A. (IT) 1991-01-15 US disclosed
EP-0317588-A1 ISOXAZOLES WITH NOOTROPIC ACTIVITY. ZAMBON SPA (IT) 1989-05-31 EP disclosed
WO-1988009330-A1 ISOXAZOLES WITH NOOTROPIC ACTIVITY ZAMBON GROUP S.P.A. (IT) 1988-12-01 WO disclosed