SCHEMBL6200422

SCHEMBL6200422

COc1cc(I)c2ncc(C(=O)NCc3ccc(Cl)cc3)c(O)c2c1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.49
MAPT P10636 3/20 0.47
ALDH1A1 P00352 1/20 0.46
LMNA P02545 2/20 0.46
EGLN1 Q9GZT9 3/20 0.45
CNR2 P34972 1/20 0.45
NR3C1 P04150 1/20 0.44
HSP90AA1 P07900 1/20 0.43
HSP90AB1 P08238 1/20 0.43
VNN1 O95497 1/20 0.43
TRPV1 Q8NER1 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL6196427 0.89 SMN1; SMN2 (0.49) SMN1; SMN2MAPTALDH1A1LMNAEGLN1
SCHEMBL6202614 0.85 EGLN1 (0.47) LMNAEGLN1CNR2NR3C1HSP90AA1
SCHEMBL6766940 0.85 EGLN1 (0.47) SMN1; SMN2ALDH1A1LMNAEGLN1CNR2
SCHEMBL6199879 0.84 KMT2A (0.46) SMN1; SMN2MAPTALDH1A1LMNAEGLN1
SCHEMBL6201571 0.84 SMN1; SMN2 (0.45) SMN1; SMN2MAPTALDH1A1LMNAEGLN1
SCHEMBL6197287 0.82 SMN1; SMN2 (0.55) SMN1; SMN2MAPTALDH1A1LMNAEGLN1
SCHEMBL6198193 0.82 EGLN1 (0.54) SMN1; SMN2ALDH1A1LMNAEGLN1CNR2
SCHEMBL6195970 0.81 EGLN1 (0.46) SMN1; SMN2MAPTALDH1A1LMNAEGLN1
SCHEMBL6199108 0.81 KMT2A (0.47) SMN1; SMN2MAPTALDH1A1LMNAEGLN1
SCHEMBL6198962 0.81 SMN1; SMN2 (0.55) SMN1; SMN2MAPTALDH1A1LMNAEGLN1

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