SCHEMBL8847756

SCHEMBL8847756

CCCn1[c]nc(-c2ccccc2)c1-c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.42
KMT2A Q03164 5/20 0.42
MAPT P10636 3/20 0.42
CRHBP P24387 3/20 0.42
CRHR2 Q13324 3/20 0.42
MAPK1 P28482 3/20 0.42
CASP1 P29466 3/20 0.42
CASP7 P55210 3/20 0.42
TSHR P16473 2/20 0.42
CYP1A2 P05177 2/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
LMNA P02545 1/20 0.39
NSD3 Q9BZ95 1/20 0.37
CRHR1 P34998 1/20 0.36
NR1H3 Q13133 1/20 0.36
KDM4E B2RXH2 2/20 0.35
KEAP1 Q14145 2/20 0.35
NFE2L2 Q16236 2/20 0.35
USP2 O75604 1/20 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
SCHEMBL8848068 0.86 LMNA (0.41) MEN1KMT2AMAPTCRHBPCRHR2
SCHEMBL7266968 0.77 NSD3 (0.42) MEN1KMT2AMAPTMAPK1CASP1
SCHEMBL8821910 0.74 MAPK14 (0.46)
SCHEMBL8848061 0.74 MEN1 (0.55) MEN1KMT2AMAPTTSHRCYP1A2
SCHEMBL8847410 0.73 KDM4E (0.50) MEN1KMT2AMAPTTSHRCYP1A2
SCHEMBL1828029 0.70 SLC9A1 (0.47) MEN1KMT2AMAPTMAPK1CASP1
SCHEMBL27372077 0.70 NSD3 (0.55) MEN1KMT2ANSD3
SCHEMBL8848208 0.69 LMNA (0.38) KMT2AMAPTTSHRLMNANSD3
SCHEMBL236752 0.68 SMN1; SMN2 (0.37) MEN1KMT2AMAPK1TSHRLMNA
SCHEMBL10615042 0.68 PTGS2 (0.59) MAPTTSHRLMNANSD3KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5614519-A (1-(2,3 or 4-N-morpholinoalkyl)-imidazol-4-yl)-benizimidazol-1-yl-methyl]-biphenyls useful as angiotensin-II antagonists KARL THOMAE GMBH (DE) 1997-03-25 US disclosed
US-5602127-A ADMINISTERING TO TREAT HYPERTENSION KARL THOMAE GMBH (DE) 1997-02-11 US disclosed
US-5594003-A HYPOTENSIVE AGENTS DR. KARL THOMAE GMBH (DE) 1997-01-14 US disclosed
US-5591762-A HYPOTENSIVE AGENTS DR. KARL THOMAE GMBH (DE) 1997-01-07 US disclosed
EP-0566020-A1 Benzimidazoles, pharmaceutical compositions thereof and processes for their preparation Dr. Karl Thomae GmbH (DE) 1993-10-20 EP disclosed