SCHEMBL16735624

SCHEMBL16735624

O=C(c1cc2ncccc2cc1O)N1CCCC2CCCCC21

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 1/20 0.43
▸ CNR2 P34972 1/20 0.43
▸ RXFP1 Q9HBX9 1/20 0.42
▸ HSD11B1 P28845 5/20 0.41
▸ HSD17B1 P14061 1/20 0.41
▸ POLB P06746 2/20 0.41
▸ RAB9A P51151 2/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ HSP90AA1 P07900 1/20 0.39
▸ HSP90AB1 P08238 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.38
▸ NR2F2 P24468 1/20 0.38
▸ HTR3A P46098 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
SCHEMBL16735587 0.90 RXFP1 (0.38) CNR1CNR2RXFP1POLBHSP90AA1
SCHEMBL16735620 0.85 KCNH2 (0.45) RXFP1POLBRAB9ANPC1SMN1; SMN2
SCHEMBL16735639 0.82 RXFP1 (0.46) RXFP1POLBHSP90AA1HTR3A
SCHEMBL16735662 0.81 HSP90AA1 (0.57) HSD11B1HSP90AA1HSP90AB1ALDH1A1
SCHEMBL2143834 0.78 ALDH1A1 (0.51) RAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL16735578 0.78 POLB (0.56) RXFP1POLBSMN1; SMN2HSP90AA1ALDH1A1
SCHEMBL4930657 0.77 POLB (0.44) CNR1CNR2RXFP1POLBHTR3A
SCHEMBL4930664 0.77 POLB (0.44) CNR1CNR2RXFP1POLBHTR3A
SCHEMBL16735670 0.76 MAPT (0.55) RXFP1POLBRAB9ANPC1SMN1; SMN2
SCHEMBL16735667 0.75 POLB (0.51) RXFP1POLBRAB9ANPC1SMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2519505-B1 TERTIARY 8-HYDROXYQUINOLINE-7-CARBOXAMIDE DERIVATIVES AND USES THEREOF POLICHEM SA (LU) 2015-05-27 — — EP claimed
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