SCHEMBL6199668

SCHEMBL6199668

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

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 3/20 0.49
NR3C1 P04150 2/20 0.45
POLA1 P09884 1/20 0.45
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
HPGD P15428 1/20 0.44
CYP2C19 P33261 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
KDM4E B2RXH2 1/20 0.42
NPC1 O15118 1/20 0.42
ALDH1A1 P00352 1/20 0.42
HTT P42858 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CD38 P28907 1/20 0.41
CNR2 P34972 1/20 0.41
TSHR P16473 1/20 0.41
LMNA P02545 1/20 0.41

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
SCHEMBL6201754 0.84 KDM4E (0.51) EGLN1NR3C1POLA1HPGDMEN1
SCHEMBL6202772 0.84 EGLN1 (0.50) EGLN1NR3C1POLA1CYP1A2CYP2C9
SCHEMBL6202284 0.84 EGLN1 (0.54) EGLN1NR3C1POLA1CYP1A2CYP2C9
SCHEMBL6198755 0.83 POLA1 (0.57) EGLN1NR3C1POLA1CYP1A2CYP2C9
SCHEMBL6198610 0.83 EGLN1 (0.56) EGLN1NR3C1POLA1CYP1A2CYP2C9
SCHEMBL6200839 0.81 EGLN1 (0.54) EGLN1NR3C1POLA1CYP1A2CYP2C9
SCHEMBL6198854 0.81 EGLN1 (0.54) EGLN1NR3C1POLA1CYP1A2CYP2C9
SCHEMBL6198193 0.81 EGLN1 (0.54) EGLN1NR3C1POLA1CYP1A2CYP2C9
SCHEMBL6219084 0.81 EGLN1 (0.54) EGLN1NR3C1POLA1CYP1A2CYP2C9
SCHEMBL6202038 0.81 EGLN1 (0.54) EGLN1NR3C1POLA1CYP1A2CYP2C9

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