SCHEMBL7969445

SCHEMBL7969445

ONCC1C2Cc3ccccc3C12

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 13/20 0.47
KDM1B Q8NB78 3/20 0.43
MAOA P21397 1/20 0.35
HTR2A P28223 1/20 0.35
HRH1 P35367 1/20 0.35
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
CYP11B2 P19099 1/20 0.34
HDAC4 P56524 1/20 0.34
HDAC7 Q8WUI4 1/20 0.34
HDAC5 Q9UQL6 1/20 0.34
MTNR1A P48039 1/20 0.34
MTNR1B P49286 1/20 0.34
PRCP P42785 1/20 0.33

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
SCHEMBL7972799 0.80 KDM1A (0.52) KDM1AKDM1BCYP11B2PRCP
SCHEMBL483392 0.72 KDM1A (0.65) KDM1AKDM1BHTR2ACYP11B2
SCHEMBL9196424 0.69 KDM1A (0.44) KDM1AKDM1B
SCHEMBL28611238 0.66 KDM1A (0.96) KDM1AKDM1BHTR2ACYP11B2
SCHEMBL11762259 0.66 MTNR1A (0.66) HTR2AHRH1HDAC4HDAC7HDAC5
SCHEMBL3912014 0.64 KDM1A (0.54) KDM1AKDM1BMAOAHDAC4HDAC7
SCHEMBL28607219 0.64 KDM1A (0.50) KDM1AKDM1BMAOACYP11B2HDAC4
SCHEMBL24278721 0.64 KDM1A (0.50) KDM1AKDM1BCYP11B2
SCHEMBL12749373 0.64 KDM1A (0.50) KDM1AKDM1BCYP11B2
SCHEMBL24278848 0.64 KDM1A (0.50) KDM1AKDM1BCYP11B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6291520-B1 INHIBIT THE ENZYME LIPOXYGENASE; TREATMENT OR ALLEVIATION OF INFLAMMATORY DISEASES, ALLERGIC CONDITIONS AND CARDIOVASCULAR DISEASES PFIZER 2001-09-18 US disclosed
EP-0559743-B1 NOVEL HYDROXAMIC ACID AND N-HYDROXYUREA DERIVATIVES AND THEIR USE PFIZER (US) 1995-03-08 EP disclosed