SCHEMBL8919988

SCHEMBL8919988

O=C(O)c1[nH]cc(-c2ccc(Cl)cc2)c1N1CCCCC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.42
ALDH1A1 P00352 3/20 0.42
HSD17B10 Q99714 2/20 0.42
ALOX15 P16050 1/20 0.42
CNR1 P21554 6/20 0.39
NOTUM Q6P988 1/20 0.39
FABP3 P05413 1/20 0.38
FABP4 P15090 1/20 0.38
FABP5 Q01469 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
LMNA P02545 1/20 0.38
AKR1C3 P42330 1/20 0.38
HTT P42858 1/20 0.38
AURKA O14965 1/20 0.36
TPX2 Q9ULW0 1/20 0.36
MAPT P10636 3/20 0.36
RAB9A P51151 2/20 0.36
ADORA1 P30542 2/20 0.36
NPC1 O15118 1/20 0.36
TSHR P16473 1/20 0.36

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
SCHEMBL9133694 0.87 ALOX15 (0.43) HPGDALDH1A1HSD17B10ALOX15NOTUM
SCHEMBL8921644 0.87 ALDH1A1 (0.57) HPGDALDH1A1HSD17B10ALOX15SMN1; SMN2
SCHEMBL9133737 0.87 ALDH1A1 (0.41) HPGDALDH1A1HSD17B10ALOX15NOTUM
SCHEMBL8921982 0.86 ALDH1A1 (0.47) HPGDALDH1A1HSD17B10ALOX15CNR1
SCHEMBL8921531 0.86 ALDH1A1 (0.54) HPGDALDH1A1HSD17B10ALOX15FABP3
SCHEMBL9857787 0.81 CNR1 (0.37) HPGDALDH1A1HSD17B10ALOX15CNR1
SCHEMBL8923331 0.75 HPGD (0.56) HPGDALDH1A1HSD17B10ALOX15SMN1; SMN2
SCHEMBL8922043 0.75 ALDH1A1 (0.67) HPGDALDH1A1HSD17B10ALOX15SMN1; SMN2
SCHEMBL9243444 0.74 ALDH1A1 (0.45) HPGDALDH1A1HSD17B10ALOX15SMN1; SMN2
SCHEMBL9132101 0.74 HPGD (0.57) HPGDALDH1A1HSD17B10ALOX15SMN1; 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5684160-A 3-aminopyrroles, methods for their synthesis and for their pharmaceutical use ARZNEIMETTELWERK DRESDEN GMBH (DE) 1997-11-04 US claimed
US-5502051-A CENTRAL NERVOUS SYSTEM, ANTISPASMODIC ARZNEIMITTELWERK DRESDEN GMBH (DE) 1996-03-26 US claimed
EP-0431371-A1 3-Aminopyrroles, process for this preparation and their use as medicaments ARZNEIMITTELWERK DRESDEN GmbH (DE) 1991-06-12 EP claimed
US-5684160-A 3-aminopyrroles, methods for their synthesis and for their pharmaceutical use ARZNEIMETTELWERK DRESDEN GMBH (DE) 1997-11-04 US disclosed
US-5502051-A CENTRAL NERVOUS SYSTEM, ANTISPASMODIC ARZNEIMITTELWERK DRESDEN GMBH (DE) 1996-03-26 US disclosed