SCHEMBL7965043

SCHEMBL7965043

O=C(O)c1ccnc(-c2nccc(C(=O)O)c2Cc2ccccc2)c1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 17/20 0.51
KDM4E B2RXH2 4/20 0.51
KDM5C P41229 4/20 0.51
KDM4A O75164 4/20 0.51
KDM6B O15054 3/20 0.51
KDM2A Q9Y2K7 3/20 0.51
KDM3A Q9Y4C1 3/20 0.51
KDM5A P29375 9/20 0.50
KDM5B Q9UGL1 9/20 0.50
KDM2B Q8NHM5 5/20 0.46
P4HA1 P13674 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
SCHEMBL7965047 0.83 KDM4E (0.47) KDM4CKDM4EKDM5CKDM4AKDM6B
SCHEMBL7962908 0.82 KDM4C (0.50) KDM4CKDM4EKDM5CKDM4AKDM6B
SCHEMBL528803 0.76 KDM4C (0.53) KDM4CKDM4EKDM5CKDM4AKDM6B
SCHEMBL730406 0.75 KDM4C (0.49) KDM4CKDM4EKDM5CKDM4AKDM6B
SCHEMBL2317461 0.75 KDM4C (0.52) KDM4CKDM4EKDM5CKDM4AKDM6B
SCHEMBL17220133 0.75 KDM4C (0.51) KDM4CKDM4EKDM5CKDM4AKDM6B
SCHEMBL7952527 0.75 KDM4C (0.53) KDM4CKDM4EKDM5CKDM4AKDM6B
SCHEMBL19197792 0.73 NAPRT (0.50) KDM4CKDM4EKDM4AKDM6BKDM5A
SCHEMBL2317463 0.73 KDM4C (0.50) KDM4CKDM4EKDM5CKDM4AKDM6B
SCHEMBL27925527 0.72 KDM4C (0.62) KDM4CKDM4EKDM5CKDM4AKDM6B

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6187928-B1 TREATING FUNGAL DISEASES THE ROCKEFELLER UNIVERSITY 2001-02-13 US disclosed
US-6087510-A Method of use of imidazolium cations THE ROCKEFELLER UNIVERSITY (US) 2000-07-11 US disclosed
US-5969150-A FLUORESCENT COMPOUNDS FOR MEDICAL DIAGNOSIS, DRUGS AND LABELS OR FUNGICIDES AND VIRICIDES THE ROCKEFELLER UNIVERSITY (US) 1999-10-19 US disclosed
US-5874587-A FLUORESCENCE THE ROCKEFELLER UNIVERSITY (US) 1999-02-23 US disclosed