SCHEMBL18892102

SCHEMBL18892102

Clc1ccc(Cl)c(-c2cc3ccccc3nc2C2Nc3ccccc3N2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.45
PKM P14618 1/20 0.45
MEN1 O00255 6/20 0.38
KMT2A Q03164 6/20 0.38
ALDH1A1 P00352 5/20 0.38
KDM4E B2RXH2 3/20 0.38
GLA P06280 1/20 0.38
MCL1 Q07820 1/20 0.38
GAA P10253 5/20 0.37
MAPT P10636 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
HPGD P15428 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
PDE2A O00408 1/20 0.36
PDE10A Q9Y233 1/20 0.36
RXFP1 Q9HBX9 1/20 0.35
POLB P06746 1/20 0.35
HTR2B P41595 1/20 0.35
PDE4D Q08499 1/20 0.35
MAPK1 P28482 2/20 0.35

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
SCHEMBL10041689 0.70 MAPT (0.41) LMNAMEN1KMT2AALDH1A1KDM4E
SCHEMBL10041690 0.68 KDM4E (0.54) LMNAPKMMEN1KMT2AALDH1A1
SCHEMBL14644256 0.66 NPC1 (0.57) PKMMEN1KMT2AALDH1A1KDM4E
SCHEMBL14644096 0.66 NPC1 (0.61) LMNAPKMMEN1KMT2AALDH1A1
SCHEMBL14644197 0.65 LMNA (0.50) LMNAMEN1KMT2AALDH1A1KDM4E
SCHEMBL10564897 0.64 KMT2A (0.46) KMT2AALDH1A1KDM4EGLAGAA
SCHEMBL29364307 0.64 TP53 (0.61) LMNAALDH1A1MAPTTDP1RXFP1
SCHEMBL440944 0.64 TP53 (0.61) LMNAALDH1A1MAPTTDP1RXFP1
SCHEMBL381603 0.62 PTPN1 (0.56) LMNAMEN1KMT2AALDH1A1MAPT
SCHEMBL29416774 0.62 PTPN1 (0.56) LMNAMEN1KMT2AALDH1A1MAPT

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
EP-2311826-B1 NOVEL NITROGEN-CONTAINING HETEROCYCLIC COMPOUND AND ORGANIC ELECTRONIC DEVICE USING THE SAME LG CHEMICAL LTD (KR) 2017-05-24 EP disclosed