SCHEMBL8309693

SCHEMBL8309693

O=C(NCCO)c1ccnnc1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 1/20 0.44
▸ CA1 P00915 1/20 0.44
▸ CA2 P00918 1/20 0.44
▸ CA3 P07451 1/20 0.44
▸ CA4 P22748 1/20 0.44
▸ CA6 P23280 1/20 0.44
▸ CA5A P35218 1/20 0.44
▸ CA7 P43166 1/20 0.44
▸ CA9 Q16790 1/20 0.44
▸ CA13 Q8N1Q1 1/20 0.44
▸ CA14 Q9ULX7 1/20 0.44
▸ CA5B Q9Y2D0 1/20 0.44
▸ POLB P06746 3/20 0.44
▸ HTT P42858 2/20 0.44
▸ HPGD P15428 1/20 0.44
▸ ALDH1A1 P00352 3/20 0.42
▸ KDM4E B2RXH2 2/20 0.42
▸ MAPT P10636 2/20 0.42
▸ CASP1 P29466 1/20 0.42
▸ CASP7 P55210 1/20 0.42

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
SCHEMBL28347782 0.77 SMN1; SMN2 (0.58) POLBHPGDALDH1A1KMT2ATDP1
SCHEMBL1849146 0.75 GPR52 (0.43) CA12CA1CA2CA3CA4
SCHEMBL7219067 0.73 CASP1 (0.64) POLBHPGDALDH1A1KDM4EMAPT
SCHEMBL1623759 0.71 SMN1; SMN2 (0.53) CA1CA2ALDH1A1KDM4EMAPT
SCHEMBL31092459 0.71 SMN1; SMN2 (0.53) CA1CA2ALDH1A1KDM4EMAPT
SCHEMBL10562435 0.71 LMNA (0.35) ALDH1A1KDM4EMAPTCASP1
SCHEMBL31092388 0.70 CASP1 (0.49) ALDH1A1KDM4ECASP1KMT2ATDP1
Hydrochloric Acid SCHEMBL10562444 0.70 SMN1; SMN2 (0.52) CA1CA2ALDH1A1KDM4EMAPT
SCHEMBL29244521 0.69 KDM4E (0.46) CA12CA1CA2CA7CA9
SCHEMBL27750343 0.69 NPC1 (0.68) POLBHTTHPGDALDH1A1KDM4E

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-0918769-A1 SUBSTITUTED PIPERAZINYL-PHENYL-OXAZOLIDINONE DERIVATIVES AND THEIR USE AS ANTI-BACTERIAL AGENTS AstraZeneca AB (SE) 1999-06-02 — — EP disclosed
WO-1998001446-A1 SUBSTITUTED PIPERAZINYL-PHENYL-OXAZOLIDINONE DERIVATIVES AND THEIR USE AS ANTI-BACTERIAL AGENTS ZENECA LIMITED (GB) 1998-01-15 — — WO disclosed
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