SCHEMBL11079083

SCHEMBL11079083

O=C(Cc1ccc(Cl)cc1Cl)N1CCN(c2cnccn2)CC1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.57
ALDH1A1 P00352 2/20 0.57
KMT2A Q03164 2/20 0.57
GRM5 P41594 4/20 0.53
EPHX2 P34913 1/20 0.53
HSD17B10 Q99714 2/20 0.48
LMNA P02545 1/20 0.48
MAPT P10636 1/20 0.48
HPGD P15428 1/20 0.48
TSHR P16473 1/20 0.48
MAPK1 P28482 1/20 0.48
ERCC1 P07992 1/20 0.47
ERCC4 Q92889 1/20 0.47
F10 P00742 1/20 0.46
SLC6A7 Q99884 1/20 0.46
DPP4 P27487 1/20 0.46
GALR3 O60755 1/20 0.45
NR2F2 P24468 1/20 0.45
POLB P06746 1/20 0.44
MC4R P32245 1/20 0.44

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
SCHEMBL11082813 0.83 GFER (0.57) KDM4EALDH1A1KMT2AHSD17B10HPGD
SCHEMBL11077598 0.82 ATM (0.51) KDM4EALDH1A1KMT2AGRM5HSD17B10
SCHEMBL11076159 0.81 ADRB2 (0.57) KDM4EALDH1A1KMT2AHSD17B10HPGD
SCHEMBL11080963 0.77 KMT2A (0.56) KDM4EALDH1A1KMT2AHSD17B10LMNA
SCHEMBL22481434 0.76 SLC6A7 (0.53) KDM4EALDH1A1KMT2AHSD17B10HPGD
SCHEMBL14411664 0.75 SLC6A7 (0.54) KDM4EALDH1A1KMT2AHSD17B10HPGD
SCHEMBL11080396 0.74 POLB (0.50) KDM4EHSD17B10LMNAMAPTHPGD
SCHEMBL11155548 0.74 L3MBTL1 (0.61) KDM4EALDH1A1KMT2ALMNAMAPT
SCHEMBL11079223 0.74 KDM4E (0.72) KDM4EALDH1A1KMT2AHSD17B10LMNA
SCHEMBL14224744 0.73 CKS1B (0.53) KDM4EALDH1A1KMT2ALMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4439606-A ANTICHOLESTEROL, ANTILIPEMIC AGENTS AMERICAN CYANAMID COMPANY (US) 1984-03-27 US claimed
US-4439606-A ANTICHOLESTEROL, ANTILIPEMIC AGENTS AMERICAN CYANAMID COMPANY (US) 1984-03-27 US disclosed
EP-0094498-A2 Antiatherosclerotic 1-piperazine derivatives AMERICAN CYANAMID COMPANY (US) 1983-11-23 EP disclosed