SCHEMBL14022033

SCHEMBL14022033

COc1ccccc1[C@@H](C)NCC(=O)Nc1c(C)cc(C)cc1C

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.65
SMN1; SMN2 Q16637 3/20 0.56
HPGD P15428 2/20 0.56
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
PKM P14618 3/20 0.50
LPAR1 Q92633 2/20 0.46
ALDH1A1 P00352 1/20 0.45
MAPT P10636 1/20 0.43
CYP3A4 P08684 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
SCHEMBL14022031 0.85 LMNA (0.47) LMNASMN1; SMN2HPGDMEN1KMT2A
SCHEMBL14022792 0.85 LMNA (0.47) LMNASMN1; SMN2HPGDMEN1KMT2A
SCHEMBL9680727 0.84 SMN1; SMN2 (0.60) LMNASMN1; SMN2HPGDMEN1KMT2A
SCHEMBL15637303 0.76 SMN1; SMN2 (0.58) LMNASMN1; SMN2HPGDKMT2ALPAR1
SCHEMBL14022673 0.76 HPGD (0.56) LMNASMN1; SMN2HPGDMEN1KMT2A
SCHEMBL9681089 0.70 KMT2A (0.57) LMNASMN1; SMN2HPGDMEN1KMT2A
Hydrochloric Acid SCHEMBL30175716 0.68 SCN1A (0.54) LMNAMEN1KMT2APKMALDH1A1
SCHEMBL10243312 0.68 L3MBTL1 (0.48) LMNASMN1; SMN2HPGDLPAR1
SCHEMBL30824617 0.68 SMN1; SMN2 (0.53) SMN1; SMN2HPGDMEN1KMT2APKM
SCHEMBL10244994 0.67 CA1 (0.53) LMNASMN1; SMN2HPGDMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008135386-A1 CHIRAL LIGANDS OF THE N-HETEROCYCLIC CARBENE TYPE FOR ASYMMETRICAL CATALYSIS ECOLE NATIONALE SUPERIEURE DE CHIMIE DE RENNES (FR) 2008-11-13 WO disclosed