SCHEMBL7794524

SCHEMBL7794524

Clc1cc(Cl)cc([N]C2CCCCC2)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.37
HTR3E A5X5Y0 2/20 0.35
HTR3B O95264 2/20 0.35
HTR3A P46098 2/20 0.35
HTR3D Q70Z44 2/20 0.35
HTR3C Q8WXA8 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
TSHR P16473 1/20 0.35
CNR1 P21554 2/20 0.34
CNR2 P34972 1/20 0.34
GRN P28799 1/20 0.33
SORT1 Q99523 1/20 0.33
GRM4 Q14833 3/20 0.33
EPHX1 P07099 2/20 0.32
ALDH1A1 P00352 1/20 0.32
ITGB3 P05106 1/20 0.31
ITGAV P06756 1/20 0.31
CXCR2 P25025 1/20 0.31
HIF1A Q16665 1/20 0.31

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
SCHEMBL7790531 0.79 HTR3E (0.38) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL7793294 0.78 HTR3E (0.44) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL7784544 0.74 HTR3E (0.41) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL723225 0.68 ALDH1A1 (0.39) KMT2ATSHRALDH1A1
SCHEMBL7794564 0.65 TSHR (0.41) KDM4EMEN1KMT2ATSHRALDH1A1
SCHEMBL3146112 0.65 ALDH1A1 (0.39) MEN1KMT2ATSHRALDH1A1GAA
SCHEMBL7418278 0.65 TSHR (0.40) MEN1KMT2ATSHRCNR1CNR2
SCHEMBL4473714 0.65 GRN (0.40) KDM4EHTR3AMEN1KMT2AGRN
SCHEMBL7794041 0.65 NPC1 (0.38) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL7793284 0.63 L3MBTL3 (0.37) MEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1150963-A1 SUBSTITUTED 4-AMINO-2-ARYLTETRAHYDROQUINAZOLINES, THEIR PREPARATION, THEIR USE AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM Aventis Pharma Deutschland GmbH (DE) 2001-11-07 EP disclosed
WO-2000046214-A1 SUBSTITUTED 4-AMINO-2-ARYLTETRAHYDROQUINAZOLINES, THEIR PREPARATION, THEIR USE AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2000-08-10 WO disclosed