SCHEMBL8095943

SCHEMBL8095943

CC(c1ccc(N)cc1)c1ccc(C(C)c2ccc(C(C)c3ccc(N)cc3)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.52
PDCD1 Q15116 1/20 0.52
ESR2 Q92731 1/20 0.52
CD274 Q9NZQ7 1/20 0.52
MEN1 O00255 3/20 0.50
MAPT P10636 3/20 0.50
KMT2A Q03164 3/20 0.50
ACHE P22303 1/20 0.45
ALDH1A1 P00352 9/20 0.42
TDP1 Q9NUW8 8/20 0.42
CYP3A4 P08684 7/20 0.42
TP53 P04637 2/20 0.42
HIF1A Q16665 2/20 0.41
HTT P42858 2/20 0.41
GAA P10253 1/20 0.41
ALOX12 P18054 1/20 0.41
MAPK1 P28482 4/20 0.39
ALOX15 P16050 3/20 0.39
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38

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
SCHEMBL3482829 1.00 ESR1 (0.52) ESR1PDCD1ESR2CD274MEN1
SCHEMBL8164161 1.00 ESR1 (0.52) ESR1PDCD1ESR2CD274MEN1
SCHEMBL140799 1.00 ESR1 (0.52) ESR1PDCD1ESR2CD274MEN1
SCHEMBL6659986 0.92 ALDH1A1 (0.58) ESR1PDCD1ESR2CD274MEN1
SCHEMBL20132351 0.89 ACHE (0.65) ESR1PDCD1ESR2CD274MEN1
SCHEMBL4672030 0.89 TSHR (0.48) ESR1PDCD1ESR2CD274MAPT
SCHEMBL22593785 0.89 ACHE (0.65) ESR1PDCD1ESR2CD274MEN1
SCHEMBL20132340 0.89 ACHE (0.65) ESR1PDCD1ESR2CD274MEN1
Sulfamide SCHEMBL11474863 0.87 CA2 (0.46) ESR1PDCD1ESR2CD274MEN1
Sulfamide SCHEMBL11473091 0.87 CA2 (0.46) ESR1PDCD1ESR2CD274MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0708077-B1 Diamino compounds and methods for preparing them CHISSO CORP (JP) 2000-12-27 EP disclosed
US-5807961-A Polyamic acid, polyimide film and liquid crystal aligning film and liquid crystal display element using the formers CHISSO CORPORATION (JP) 1998-09-15 US disclosed
EP-0799270-A1 POLYAMIC ACID, POLYIMIDE FILM AND LIQUID CRYSTAL ALIGNING FILM AND LIQUID CRYSTAL DISPLAY ELEMENT CHISSO CORPORATION (JP) 1997-10-08 EP disclosed
US-5663440-A Diamino compounds and methods for preparing them CHISSO CORPORATION (JP) 1997-09-02 US disclosed
WO-1997014742-A1 POLYAMIC ACID, POLYIMIDE FILM AND LIQUID CRYSTAL ALIGNING FILM AND LIQUID CRYSTAL DISPLAY ELEMENT CHISSO CORPORATION (JP) 1997-04-24 WO disclosed
EP-0708077-A1 Diamino compounds and methods for preparing them CHISSO CORPORATION (JP) 1996-04-24 EP disclosed