SCHEMBL16499203

SCHEMBL16499203

O=C(O)c1ccc2c(Cl)n(-c3ccccc3)nc2n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ RPA1 P27694 1/20 0.44
▸ PPP1CA P62136 1/20 0.44
▸ ALDH1A1 P00352 5/20 0.42
▸ KDM4E B2RXH2 3/20 0.42
▸ HPGD P15428 3/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ ESR2 Q92731 1/20 0.41
▸ LMNA P02545 3/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ MGAM O43451 1/20 0.40
▸ MARS1 P56192 1/20 0.40
▸ CHEK1 O14757 1/20 0.40
▸ AURKA O14965 1/20 0.40
▸ CSNK1A1 P48729 1/20 0.40
▸ CDK8 P49336 1/20 0.40
▸ NEK2 P51955 1/20 0.40
▸ LIMK1 P53667 1/20 0.40
▸ CDK5 Q00535 1/20 0.40

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
SCHEMBL16498311 0.82 CYP2C19 (0.50) L3MBTL1RPA1PPP1CAALDH1A1SMN1; SMN2
SCHEMBL16498386 0.82 MAPT (0.50) ALDH1A1KDM4EHPGDLMNAKMT2A
SCHEMBL16498309 0.76 KEAP1 (0.43) L3MBTL1RPA1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL11730545 0.75 RAB9A (0.42) L3MBTL1ALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL16512866 0.73 PTGER1 (0.46) L3MBTL1RPA1PPP1CAALDH1A1SMN1; SMN2
SCHEMBL16512870 0.73 BCAT1 (0.41) ALDH1A1KDM4EHPGDSMN1; SMN2ESR2
SCHEMBL19465578 0.72 KDM4E (0.60) L3MBTL1ALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL16512869 0.69 ESR2 (0.46) L3MBTL1ALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL924712 0.67 RPA1 (0.56) L3MBTL1RPA1PPP1CAALDH1A1SMN1; SMN2
SCHEMBL6681735 0.67 HPGD (0.69) ALDH1A1HPGDSMN1; SMN2LMNAKMT2A

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
WO-2011153588-A1 VIRAL POLYMERASE INHIBITORS BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2011-12-15 — — WO disclosed
WO-2011153588-A1 VIRAL POLYMERASE INHIBITORS BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2011-12-15 — — WO disclosed
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