SCHEMBL1665524

SCHEMBL1665524

O=C(O)c1ccc(C2CC(O)CN2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 3/20 0.41
▸ TP53 P04637 1/20 0.41
▸ SRD5A2 P31213 2/20 0.38
▸ CA1 P00915 2/20 0.36
▸ CA2 P00918 2/20 0.36
▸ CA12 O43570 1/20 0.36
▸ CA3 P07451 1/20 0.36
▸ TYR P14679 1/20 0.36
▸ DRD1 P21728 1/20 0.36
▸ CA4 P22748 1/20 0.36
▸ CA6 P23280 1/20 0.36
▸ CA5A P35218 1/20 0.36
▸ CA7 P43166 1/20 0.36
▸ CA9 Q16790 1/20 0.36
▸ CA14 Q9ULX7 1/20 0.36
▸ CA5B Q9Y2D0 1/20 0.36
▸ GRIK1 P39086 3/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ TPMT P51580 1/20 0.35
▸ ALDH1A1 P00352 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
SCHEMBL6142909 0.80 GBA1 (0.46) —
SCHEMBL5739415 0.80 GBA1 (0.46) —
SCHEMBL27603362 0.77 SCN10A (0.35) CA3CA6CA14ALOX15ALDH1A1
SCHEMBL4685465 0.77 CDC7 (0.40) ALDH1A1SMN1; SMN2
SCHEMBL8046771 0.76 ALDH5A1 (0.36) ALDH1A1SMN1; SMN2
SCHEMBL8046766 0.76 ALDH5A1 (0.36) ALDH1A1SMN1; SMN2
SCHEMBL8565971 0.73 SCN10A (0.38) ALDH1A1
SCHEMBL13801056 0.72 KDM1A (0.44) CA1CA2CA12CA7CA9
SCHEMBL15203702 0.72 TSHR (0.41) TSHRTP53SRD5A2CA1CA2
SCHEMBL92405 0.72 PKM (0.44) TSHRTP53SRD5A2ALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2488486-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES Ligand Pharmaceuticals Inc. (US) 2012-08-22 — — EP disclosed
WO-2011046954-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES LIGAND PHARMACEUTICALS INC. (US) 2011-04-21 — — WO disclosed
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