SCHEMBL8885290

SCHEMBL8885290

CN(C(=O)c1ccccc1)c1ccccc1CBr

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.44
KMT2A Q03164 4/20 0.42
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.40
HPGD P15428 1/20 0.40
NR1H2 P55055 1/20 0.40
NR1H3 Q13133 1/20 0.40
PTPN1 P18031 1/20 0.40
GSK3B P49841 1/20 0.40
NPC1 O15118 1/20 0.40
LMNA P02545 1/20 0.40
TP53 P04637 1/20 0.40
CASP3 P42574 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40
EGFR P00533 1/20 0.40
ERBB2 P04626 1/20 0.40

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
SCHEMBL4510192 0.84 ALDH1A1 (0.38) KMT2AKDM4EALDH1A1HPGDPTPN1
SCHEMBL9001643 0.82 KMT2A (0.53) HSD11B1KMT2AKDM4EALDH1A1HPGD
SCHEMBL11256211 0.81 PPARG (0.42) KMT2AKDM4ENR1H2NR1H3NPC1
SCHEMBL11257623 0.78 HDAC3 (0.45) KMT2AKDM4EALDH1A1NPC1CASP3
SCHEMBL28867944 0.77 KMT2A (0.46) HSD11B1KMT2AKDM4EALDH1A1HPGD
SCHEMBL8812454 0.77 KMT2A (0.49) HSD11B1KMT2AKDM4EALDH1A1HPGD
SCHEMBL28272164 0.77 TSPO (0.37) KMT2AALDH1A1HPGDLMNATP53
SCHEMBL9049204 0.75 POLQ (0.39) KDM4EALDH1A1TP53SMN1; SMN2CES1
SCHEMBL3807892 0.75 ALDH1A1 (0.51) KMT2AKDM4EALDH1A1
SCHEMBL8614764 0.75 ALDH1A1 (0.44) HSD11B1KMT2AKDM4EALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5596020-A Amino bi- and tri-carbocyclic alkane bis-aryl squalene synthase inhibitors RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1997-01-21 US disclosed
US-5561143-A ANTICHOLESTEROL AGENTS, ANTILIPEMIC AGENTS RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1996-10-01 US disclosed
US-5534532-A ANTICHOLESTEROL AGENTS, SQUALENE SYNTHASE INHIBITOR RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1996-07-09 US disclosed
US-5494918-A ANTICHOLESTEROL AGENTS RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1996-02-27 US disclosed
US-5455260-A Anticholesterol agents; reduction of serum cholesterol without reducing mevalonic metabolite synthesis; side effect RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1995-10-03 US disclosed
US-5395846-A Amino Bi- and tri-carbocyclic aklane bis-aryl squalene synthase inhibitors RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1995-03-07 US disclosed
US-5385912-A Hypocholesterolemic or hypolipidemic agents RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1995-01-31 US disclosed
WO-1995000146-A1 AMINO BI- AND TRI-CARBOCYCLIC ALKANE BIS-ARYL SQUALENE SYNTHASE INHIBITORS RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1995-01-05 WO disclosed
WO-1994027601-A1 ALIPHATIC AMINO BIS-ARYL SQUALENE SYNTHASE INHIBITORS RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1994-12-08 WO disclosed
WO-1992015579-A1 MULTICYCLIC TERTIARY AMINE POLYAROMATIC SQUALENE SYNTHETASE INHIBITORS RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) 1992-09-17 WO disclosed