SCHEMBL10439648

SCHEMBL10439648

O=[C]Cc1cccc(Nc2c(Cl)cccc2Cl)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAPGEF4 Q8WZA2 1/20 0.40
▸ TOP2A P11388 1/20 0.36
▸ TOP2B Q02880 1/20 0.36
▸ CAMK2A Q9UQM7 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ PTGS2 P35354 3/20 0.35
▸ CXCL8 P10145 2/20 0.35
▸ PTGS1 P23219 2/20 0.35
▸ AKR1B10 O60218 1/20 0.35
▸ UGT1A9 O60656 1/20 0.35
▸ TRPA1 O75762 1/20 0.35
▸ ABCB11 O95342 1/20 0.35
▸ MT-CO2 P00403 1/20 0.35
▸ TTR P02766 1/20 0.35
▸ ALB P02768 1/20 0.35
▸ UGT1A6 P19224 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
SCHEMBL10439609 0.84 NPC1 (0.43) RAPGEF4TOP2ATOP2BMEN1LMNA
SCHEMBL10439650 0.79 RAPGEF4 (0.41) RAPGEF4TOP2ATOP2BCAMK2AMEN1
SCHEMBL10439645 0.78 RAPGEF4 (0.42) RAPGEF4TOP2ATOP2BCAMK2AMEN1
SCHEMBL10439857 0.78 TOP2A (0.56) RAPGEF4TOP2ATOP2BALDH1A1SIGMAR1
SCHEMBL1425327 0.76 PTGS2 (0.54) CAMK2APTGS2CXCL8PTGS1AKR1B10
SCHEMBL6895272 0.72 MEN1 (0.41) MEN1KMT2A
SCHEMBL1759063 0.71 TAAR1 (0.55) SIGMAR1CYP3A4TSHR
SCHEMBL4786132 0.69 TTR (0.60) CAMK2AALDH1A1LMNAKMT2APTGS2
SCHEMBL9781898 0.69 NR3C1 (0.52) ALDH1A1LMNAPTGS1ADRA1ACYP3A4
SCHEMBL11202832 0.69 NPSR1 (0.55) MEN1ALDH1A1MAPTKMT2ATSHR

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
EP-0377896-A2 Cyclooxygenase and 5-lipoxygenase inhibiting hydroxamic acid derivatives CIBA-GEIGY AG (CH) 1990-07-18 — — EP disclosed
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