SCHEMBL2724939

SCHEMBL2724939

Oc1cnc2cc(F)ccc2n1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.55
▸ KMT2A Q03164 3/20 0.44
▸ PDGFRB P09619 2/20 0.40
▸ PDGFRA P16234 2/20 0.40
▸ MAPT P10636 4/20 0.40
▸ MAPK1 P28482 2/20 0.40
▸ BACE1 P56817 1/20 0.37
▸ ALPL P05186 1/20 0.36
▸ ALPI P09923 1/20 0.36
▸ ALPG P10696 1/20 0.36
▸ CA3 P07451 1/20 0.35
▸ CA6 P23280 1/20 0.35
▸ CA5A P35218 1/20 0.35
▸ CA9 Q16790 1/20 0.35
▸ CA14 Q9ULX7 1/20 0.35
▸ CA5B Q9Y2D0 1/20 0.35
▸ AXL P30530 1/20 0.35
▸ GFER P55789 1/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ HTT P42858 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
SCHEMBL621588 0.92 KDM4E (0.55) KDM4EKMT2APDGFRBPDGFRAMAPT
SCHEMBL14582923 0.79 ESR2 (0.48) KDM4EKMT2APDGFRBPDGFRAMAPT
SCHEMBL20774316 0.77 PDGFRB (0.36) KDM4EPDGFRBPDGFRAALDH1A1
SCHEMBL1258593 0.76 ALDH1A1 (0.52) KDM4EKMT2APDGFRBPDGFRAMAPT
SCHEMBL8530324 0.76 HRH4 (0.47) KDM4EKMT2APDGFRBPDGFRAMAPT
SCHEMBL1128647 0.76 PABPC1 (0.44) KMT2ABACE1MEN1HTTCYP1A2
SCHEMBL15688492 0.76 KDM4E (0.46) KDM4EKMT2APDGFRBPDGFRAMAPT
SCHEMBL29880393 0.76 BACE1 (0.55) KDM4EKMT2APDGFRBPDGFRAMAPT
SCHEMBL101566 0.76 KMT2A (0.48) KDM4EKMT2APDGFRBPDGFRABACE1
SCHEMBL30665754 0.76 HRH4 (0.47) KDM4EKMT2APDGFRBPDGFRAMAPT

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-2012052556-A1 NOVEL HALOALKOXYQUINAZOLINES, AND PREPARATION AND USE THEREOF UNIVERSITÄT LEIPZIG (DE) 2012-04-26 — — WO disclosed
US-4582526-A Carbamic acid ester herbicides HOFFMANN-LA ROCHE INC. (US) 1986-04-15 — — US disclosed
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