SCHEMBL6202038

SCHEMBL6202038

O=C(NCc1ccc(Cl)cc1)c1cnc2c(Br)cccc2c1O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 2/20 0.54
POLA1 P09884 1/20 0.49
NR3C1 P04150 2/20 0.47
ALDH1A1 P00352 4/20 0.46
HTT P42858 2/20 0.46
KDM4E B2RXH2 1/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HPGD P15428 4/20 0.45
CYP1A2 P05177 2/20 0.45
CYP2C19 P33261 2/20 0.45
TSHR P16473 1/20 0.45
CYP2C9 P11712 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
MAPT P10636 1/20 0.45
THRB P10828 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
KMT2A Q03164 2/20 0.45
CNR2 P34972 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
SCHEMBL6198755 0.88 POLA1 (0.57) EGLN1POLA1NR3C1ALDH1A1HTT
SCHEMBL6198610 0.88 EGLN1 (0.56) EGLN1POLA1NR3C1ALDH1A1HTT
SCHEMBL6198854 0.86 EGLN1 (0.54) EGLN1POLA1NR3C1ALDH1A1HTT
SCHEMBL6219084 0.86 EGLN1 (0.54) EGLN1POLA1NR3C1ALDH1A1HTT
SCHEMBL6202284 0.86 EGLN1 (0.54) EGLN1POLA1NR3C1ALDH1A1HTT
SCHEMBL6200839 0.86 EGLN1 (0.54) EGLN1POLA1NR3C1ALDH1A1HTT
SCHEMBL6198193 0.86 EGLN1 (0.54) EGLN1POLA1NR3C1ALDH1A1HTT
SCHEMBL6198531 0.84 EGLN1 (0.52) EGLN1POLA1NR3C1ALDH1A1HTT
SCHEMBL6202822 0.83 EGLN1 (0.51) EGLN1POLA1NR3C1ALDH1A1HTT
SCHEMBL6197994 0.83 KMT2A (0.54) EGLN1POLA1NR3C1ALDH1A1HTT

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-1042295-B1 4-HYDROXYQUINOLINE-3-CARBOXAMIDES AND HYDRAZIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN CO LLC (US) 2005-09-07 EP claimed