SCHEMBL11145662

SCHEMBL11145662

N#CC1COC(=O)N1Cc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ EHMT2 Q96KQ7 1/20 0.42
▸ ALDH1A1 P00352 2/20 0.40
▸ SIGMAR1 Q99720 1/20 0.39
▸ DRD2 P14416 5/20 0.38
▸ DRD3 P35462 5/20 0.38
▸ DPP4 P27487 2/20 0.37
▸ LTA4H P09960 1/20 0.37
▸ HDAC1 Q13547 2/20 0.37
▸ F2 P00734 1/20 0.37
▸ PLG P00747 1/20 0.37
▸ ELANE P08246 1/20 0.37
▸ CTSG P08311 1/20 0.37
▸ CMA1 P23946 1/20 0.37
▸ CTRC Q99895 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ CYP2C19 P33261 1/20 0.37
▸ FAAH O00519 1/20 0.36

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
SCHEMBL5216973 0.76 EHMT2 (0.50) EHMT2ALDH1A1SIGMAR1DRD2DRD3
SCHEMBL16118500 0.76 KMT2A (0.46) EHMT2ALDH1A1SIGMAR1HDAC1CYP3A4
SCHEMBL19546169 0.76 NAAA (0.49) EHMT2SIGMAR1ELANECTSG
SCHEMBL5218217 0.76 EHMT2 (0.50) EHMT2ALDH1A1SIGMAR1DRD2DRD3
SCHEMBL23769091 0.76 DRD2 (0.40) SIGMAR1DRD2DRD3LTA4H
SCHEMBL31490161 0.76 DRD2 (0.40) SIGMAR1DRD2DRD3LTA4H
SCHEMBL29135687 0.75 EHMT2 (0.45) EHMT2ALDH1A1SIGMAR1DRD2DRD3
SCHEMBL29135683 0.75 EHMT2 (0.45) EHMT2ALDH1A1SIGMAR1DRD2DRD3
SCHEMBL7447005 0.75 HDAC1 (0.55) EHMT2HDAC1
SCHEMBL31490139 0.74 KMT2A (0.41) ALDH1A1CYP3A4CYP2C19

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-4410532-A N-Substituted aziridine-2-carboxylic acid derivatives and their immuno-stimulation compositions and methods BOEHRINGER MANNHEIM GMBH (DE) 1983-10-18 — — US disclosed
US-4409236-A N-Substituted aziridine-2-carboxylic acid derivatives and immuno-stimulation composition and method BOEHRINGER MANNHEIM GMBH (DE) 1983-10-11 — — US disclosed
US-4321194-A N-Substituted aziridine-2-carboxylic acid derivatives for immuno stimulation BOEHRINGER MANNHEIM GMBH (DE) 1982-03-23 — — US disclosed
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