SCHEMBL16735658

SCHEMBL16735658

O=C(c1cc2ncccc2cc1O)N1CCOCC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.53
▸ HSP90AA1 P07900 2/20 0.52
▸ HSP90AB1 P08238 1/20 0.49
▸ RIPK1 Q13546 1/20 0.48
▸ MKNK1 Q9BUB5 1/20 0.48
▸ MKNK2 Q9HBH9 1/20 0.48
▸ CCNC P24863 1/20 0.47
▸ CDK8 P49336 1/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ LMNA P02545 1/20 0.47
▸ TSHR P16473 1/20 0.47
▸ NPC1 O15118 2/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ SMN1; SMN2 Q16637 4/20 0.46
▸ RORC P51449 1/20 0.45
▸ KDM4E B2RXH2 3/20 0.45
▸ MAPT P10636 1/20 0.45
▸ SLC40A1 Q9NP59 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44

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
SCHEMBL16735578 0.88 POLB (0.56) POLBHSP90AA1RIPK1ALDH1A1LMNA
SCHEMBL16735619 0.84 POLB (0.52) POLBHSP90AA1RAB9AKDM4EGRM4
SCHEMBL16735667 0.82 POLB (0.51) POLBALDH1A1TSHRNPC1RAB9A
SCHEMBL8120522 0.82 NPC1 (0.62) POLBHSP90AA1HSP90AB1ALDH1A1LMNA
SCHEMBL16735593 0.81 RXFP1 (0.56) POLB
SCHEMBL16735647 0.81 POLB (0.49) POLBHSP90AA1ALDH1A1LMNARAB9A
SCHEMBL16735636 0.81 HSP90AA1 (0.62) POLBHSP90AA1HSP90AB1
SCHEMBL16735605 0.80 POLB (0.51) POLBALDH1A1
SCHEMBL31428757 0.79 RIPK1 (0.59) POLBRIPK1MKNK1MKNK2SMN1; SMN2
SCHEMBL6984876 0.79 MKNK1 (0.62) RIPK1MKNK1MKNK2CCNCCDK8

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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