SCHEMBL11215182

SCHEMBL11215182

C=CC(OC1CCCCO1)N1CC2NCCc3c2n(c2ccccc32)C1=O

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34

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
SCHEMBL11206732 0.78 MEN1 (0.38) MEN1ALDH1A1HPGDKMT2AHSD17B10
SCHEMBL11185516 0.77 MEN1 (0.35) MEN1ALDH1A1HPGDKMT2AHSD17B10
SCHEMBL11187463 0.74 HSD17B10 (0.39) MEN1ALDH1A1HPGDKMT2AHSD17B10
SCHEMBL11498962 0.72 CYP3A4 (0.39) MEN1ALDH1A1KMT2AHSD17B10
SCHEMBL11187623 0.69 HSD17B10 (0.41) MEN1ALDH1A1HPGDKMT2AHSD17B10
SCHEMBL11185140 0.66 HSD17B10 (0.39) MEN1ALDH1A1HPGDKMT2AHSD17B10
SCHEMBL11470919 0.66 HSD17B10 (0.57) MEN1ALDH1A1HPGDKMT2AHSD17B10
SCHEMBL10836067 0.65 HSD17B10 (0.50) MEN1ALDH1A1HPGDKMT2AHSD17B10
SCHEMBL11185552 0.65 HPGD (0.38) MEN1ALDH1A1HPGDKMT2AHSD17B10
Hydrochloric Acid SCHEMBL11469730 0.65 HSD17B10 (0.60) MEN1ALDH1A1HPGDKMT2AHSD17B10

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-4367230-A ANTIANOXIC AGENTS TANABE SEIYAKU CO., LTD. (JP) 1983-01-04 — — US disclosed
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