SCHEMBL7811945

SCHEMBL7811945

CN(C)CC1=CC=C2N=c3ccccc3=C2C1=O

nearest known ligand 0.31

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.31
POLB P06746 2/20 0.31
MAPT P10636 3/20 0.30
LMNA P02545 2/20 0.30
KMT2A Q03164 2/20 0.30
CCR6 P51684 1/20 0.30
ALDH1A1 P00352 3/20 0.30
MEN1 O00255 1/20 0.30
PKM P14618 1/20 0.30
MAPK10 P53779 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL7811940 0.70 MAPT (0.33) ATMPOLBMAPTLMNAKMT2A
SCHEMBL5734376 0.68 MAPT (0.32) POLBMAPTLMNAKMT2ACCR6
SCHEMBL30101244 0.64 ALDH1A1 (0.31) POLBMAPTLMNAKMT2AALDH1A1
SCHEMBL793243 0.64 MAPT (0.38) ATMPOLBMAPTLMNAKMT2A
SCHEMBL1649691 0.64 MAPT (0.38) ATMPOLBMAPTLMNAKMT2A
SCHEMBL6278365 0.64 MAPT (0.35) ATMPOLBMAPTLMNAKMT2A
SCHEMBL6571089 0.63 ALDH1A1 (0.36) POLBMAPTLMNAKMT2AALDH1A1
SCHEMBL897853 0.62 CDC25B (0.38) ATMPOLBMAPTLMNAKMT2A
SCHEMBL29161382 0.60 MAPT (0.54) ATMPOLBMAPTLMNAKMT2A
SCHEMBL1120400 0.57 MAPT (0.38) ATMPOLBMAPTLMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0595111-B2 Carbazolone derivatives and process for preparing the same RICHTER GEDEON VEGYESZET (HU) 2001-08-16 EP disclosed
EP-0595111-B1 Carbazolone derivatives and process for preparing the same RICHTER GEDEON VEGYESZET (HU) 1997-09-10 EP disclosed
US-5478949-A Reacting the starting carbazolone with dialkyl oxalate, then formaldehyde and 2-methylimidazole RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 1995-12-26 US disclosed
US-5416221-A ONDANSETRON INTERMEDIATES RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 1995-05-16 US disclosed
EP-0595111-A1 Carbazolone derivatives and process for preparing the same RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) 1994-05-04 EP disclosed