SCHEMBL7722872

SCHEMBL7722872

CCn1c2ccccc2c2cc(NC(=O)c3ccccc3)ccc21

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 15/20 0.75
MEN1 O00255 11/20 0.75
KMT2A Q03164 11/20 0.75
KDM4E B2RXH2 9/20 0.75
LMNA P02545 7/20 0.75
ALDH1A1 P00352 6/20 0.75
SMN1; SMN2 Q16637 4/20 0.75
HPGD P15428 4/20 0.75
HCRTR1 O43613 2/20 0.75
RAB9A P51151 2/20 0.75
NPC1 O15118 1/20 0.75
PAX8 Q06710 1/20 0.74
NPSR1 Q6W5P4 2/20 0.74
L3MBTL1 Q9Y468 1/20 0.72
POLB P06746 4/20 0.71
RECQL P46063 1/20 0.71
HTT P42858 1/20 0.71
MAPK1 P28482 1/20 0.71
BLM P54132 1/20 0.71
TDP1 Q9NUW8 1/20 0.71

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
SCHEMBL6226561 0.91 MAPT (0.74) MAPTMEN1KMT2AKDM4ELMNA
SCHEMBL4728014 0.90 MAPT (0.72) MAPTMEN1KMT2AKDM4ELMNA
SCHEMBL4725265 0.90 NPY5R (0.72) MAPTMEN1KMT2AKDM4ELMNA
SCHEMBL4725807 0.90 MAPT (0.72) MAPTMEN1KMT2AKDM4ELMNA
SCHEMBL16295912 0.89 MAPT (0.61) MAPTMEN1KMT2AKDM4ELMNA
SCHEMBL4727129 0.88 MAPT (0.73) MAPTMEN1KMT2AKDM4ELMNA
SCHEMBL30138765 0.88 MAPT (0.70) MAPTMEN1KMT2AKDM4ELMNA
SCHEMBL4728662 0.88 MAPT (0.70) MAPTMEN1KMT2AKDM4ELMNA
SCHEMBL28906026 0.88 MAPT (0.70) MAPTMEN1KMT2AKDM4ELMNA
SCHEMBL6231487 0.88 MAPT (0.83) MAPTMEN1KMT2AKDM4ELMNA

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
EP-2989102-B1 CARBAZOLE DIOXAZINE PIGMENTS GHARDA KEKI HORMUSJI (IN) 2018-11-28 EP claimed
US-6399631-B1 3-AMIDO OR 3-SULFONAMIDO; EATING DISORDERS IN HUMANS, DOGS AND CATS PFIZER INC. 2002-06-04 US disclosed