SCHEMBL10608957

SCHEMBL10608957

O=C(COc1cc(-c2ccccc2)nc2ccccc12)N1CCC(O)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACP1 P24666 1/20 0.50
ACACA Q13085 3/20 0.47
MAPT P10636 4/20 0.47
ALDH1A1 P00352 4/20 0.47
HPGD P15428 3/20 0.47
KDM4E B2RXH2 3/20 0.47
HSD17B10 Q99714 3/20 0.47
MEN1 O00255 2/20 0.47
MAPK1 P28482 2/20 0.47
KMT2A Q03164 2/20 0.47
USP2 O75604 1/20 0.47
HSP90AA1 P07900 1/20 0.47
TP53 P04637 2/20 0.47
NPSR1 Q6W5P4 2/20 0.47
CASP1 P29466 1/20 0.47
CASP7 P55210 1/20 0.47
TDP1 Q9NUW8 2/20 0.47
LMNA P02545 3/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45

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
Hydrochloric Acid SCHEMBL10608889 0.99 ACP1 (0.49) ACP1ACACAMAPTALDH1A1HPGD
SCHEMBL10612832 0.89 ACP1 (0.60) ACP1ACACAMAPTALDH1A1HPGD
SCHEMBL10610813 0.89 HPGD (0.49) ACP1ACACAMAPTALDH1A1HPGD
SCHEMBL10613513 0.88 ACP1 (0.61) ACP1MAPTALDH1A1HPGDKDM4E
Hydrochloric Acid SCHEMBL10612258 0.87 ACP1 (0.60) ACP1MAPTALDH1A1HPGDKDM4E
SCHEMBL10612321 0.86 ACP1 (0.51) ACP1ACACAMAPTALDH1A1HPGD
SCHEMBL10610688 0.86 ALDH1A1 (0.61) ACP1MAPTALDH1A1HPGDKDM4E
SCHEMBL10609452 0.85 USP2 (0.58) MAPTALDH1A1KDM4EMEN1MAPK1
Hydrochloric Acid SCHEMBL10613447 0.85 HPGD (0.56) ACP1ACACAMAPTALDH1A1HPGD
SCHEMBL10612869 0.85 LMNA (0.50) ACP1ACACAMAPTALDH1A1HPGD

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-4728647-A Amides derived from quinoline, and anxiolytic compositions containing them RHONE-POULENC SANTE (FR) 1988-03-01 US disclosed