SCHEMBL11861407

SCHEMBL11861407

O=C(COc1ccccc1)N1CCNC1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 3/20 1.00
▸ L3MBTL1 Q9Y468 2/20 0.64
▸ MEN1 O00255 2/20 0.59
▸ KMT2A Q03164 2/20 0.59
▸ CRHBP P24387 1/20 0.56
▸ CRHR2 Q13324 1/20 0.56
▸ NPC1 O15118 2/20 0.56
▸ RAB9A P51151 2/20 0.56
▸ MAPT P10636 1/20 0.56
▸ SMN1; SMN2 Q16637 1/20 0.56
▸ USP2 O75604 1/20 0.51
▸ KDM4E B2RXH2 1/20 0.51
▸ HSD17B10 Q99714 1/20 0.51
▸ ALDH1A1 P00352 2/20 0.50
▸ POLB P06746 2/20 0.49
▸ TDP1 Q9NUW8 2/20 0.48
▸ LMNA P02545 2/20 0.48
▸ ALOX15 P16050 1/20 0.47
▸ ME2 P23368 1/20 0.47
▸ ME1 P48163 1/20 0.47

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
SCHEMBL11377517 0.76 HSD17B10 (0.67) GAAL3MBTL1MAPTUSP2HSD17B10
SCHEMBL6823988 0.76 GAA (0.61) GAAL3MBTL1MEN1KMT2ANPC1
SCHEMBL10721826 0.75 MEN1 (1.00) GAAL3MBTL1MEN1KMT2AMAPT
SCHEMBL5072941 0.75 MEN1 (0.78) GAAL3MBTL1MEN1KMT2ASMN1; SMN2
Hydrochloric Acid SCHEMBL211137 0.74 MEN1 (0.76) GAAL3MBTL1MEN1KMT2ASMN1; SMN2
SCHEMBL18716598 0.74 GAA (0.58) GAACRHBPCRHR2NPC1RAB9A
SCHEMBL9722707 0.72 CRHBP (1.00) GAAMEN1KMT2ACRHBPCRHR2
SCHEMBL6229273 0.72 GAA (0.56) GAAMEN1KMT2ANPC1RAB9A
SCHEMBL29516320 0.72 MEN1 (0.86) GAAL3MBTL1MEN1KMT2ANPC1
SCHEMBL3404241 0.72 RAB9A (1.00) GAAMEN1KMT2ANPC1RAB9A

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
US-3931216-A Process for the manufacture of 2-arylamino-2-imidazoline derivatives and their salts BOEHRINGER INGELHEIM GMBH (DT) 1976-01-06 — — US disclosed
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