SCHEMBL6091775

SCHEMBL6091775

O=C1NN=C(c2ccno2)C1=Cc1[nH]c2c(c1CN1CCCCC1)CCCC2

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SRC P12931 18/20 0.43
KDR P35968 13/20 0.43
FGFR1 P11362 12/20 0.43
LCK P06239 9/20 0.43
FYN P06241 9/20 0.43
YES1 P07947 9/20 0.43
PDGFRB P09619 11/20 0.36
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
GLA P06280 2/20 0.33
GAA P10253 2/20 0.33
HPGD P15428 2/20 0.33
USP2 O75604 1/20 0.33
LMNA P02545 1/20 0.33
EGFR P00533 1/20 0.33

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
SCHEMBL6091770 1.00 SRC (0.43) SRCKDRFGFR1LCKFYN
SCHEMBL6089844 0.99 SRC (0.43) SRCKDRFGFR1LCKFYN
SCHEMBL6089850 0.99 SRC (0.43) SRCKDRFGFR1LCKFYN
SCHEMBL6092169 0.93 SRC (0.51) SRCKDRFGFR1LCKFYN
SCHEMBL6092158 0.93 SRC (0.51) SRCKDRFGFR1LCKFYN
SCHEMBL6089657 0.92 SRC (0.45) SRCKDRFGFR1LCKFYN
SCHEMBL6089664 0.92 SRC (0.45) SRCKDRFGFR1LCKFYN
SCHEMBL6090223 0.86 SRC (0.43) SRCKDRFGFR1LCKFYN
SCHEMBL6090215 0.86 SRC (0.43) SRCKDRFGFR1LCKFYN
SCHEMBL6091140 0.85 SRC (0.43) SRCKDRFGFR1LCKFYN

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-7060822-B1 2-pyrazolin-5-ones ABBOTT GMBH & CO. KG (DE) 2006-06-13 US disclosed