SCHEMBL6197922

SCHEMBL6197922

CN(CCS(=O)(=O)O)C(=O)CCCCCCC(=O)OCCCc1ccc2ncc(C(=O)NCc3ccc(Cl)cc3)c(O)c2c1

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 2/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
KDM4E B2RXH2 1/20 0.34
GAA P10253 1/20 0.34
LMNA P02545 3/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CCR1 P32246 2/20 0.33
HPGD P15428 1/20 0.32
MAPT P10636 1/20 0.32
EGLN1 Q9GZT9 1/20 0.32
MAOB P27338 1/20 0.32
THRB P10828 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TP53 P04637 1/20 0.32

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
SCHEMBL6202868 0.99 NR3C1 (0.34) NR3C1MEN1KMT2AKDM4EGAA
SCHEMBL6197621 0.94 NR3C1 (0.34) NR3C1MEN1KMT2AKDM4EGAA
SCHEMBL6200160 0.90 NR3C1 (0.33) NR3C1MEN1KMT2ALMNASMN1; SMN2
SCHEMBL6199997 0.89 NR3C1 (0.33) NR3C1MEN1KMT2ALMNASMN1; SMN2
SCHEMBL6198743 0.86 EGLN1 (0.35) NR3C1MEN1KMT2AKDM4EGAA
SCHEMBL6199424 0.86 EGLN1 (0.35) NR3C1MEN1KMT2AKDM4EGAA
SCHEMBL6682523 0.85 EGLN1 (0.38) NR3C1KDM4ELMNASMN1; SMN2HPGD
SCHEMBL6199988 0.83 LMNA (0.32) NR3C1MEN1KMT2ALMNASMN1; SMN2
SCHEMBL6199416 0.81 EGLN1 (0.34) NR3C1MEN1KMT2ACCR1EGLN1
SCHEMBL6669431 0.81 LMNA (0.33) NR3C1MEN1KMT2AKDM4ELMNA

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