SCHEMBL8540598

SCHEMBL8540598

COc1ccc(C(O)CCCCCn2ccnc2)c(OC)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ QPCT Q16769 4/20 0.53
▸ KMT2A Q03164 2/20 0.51
▸ MEN1 O00255 1/20 0.51
▸ ATM Q13315 1/20 0.51
▸ LMNA P02545 3/20 0.48
▸ KDM4E B2RXH2 2/20 0.48
▸ TLR9 Q9NR96 1/20 0.48
▸ TLR7 Q9NYK1 1/20 0.48
▸ GAA P10253 1/20 0.47
▸ TBXAS1 P24557 3/20 0.46
▸ TSHR P16473 2/20 0.46
▸ TP53 P04637 1/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ CYP2D6 P10635 1/20 0.46
▸ CYP2C9 P11712 1/20 0.46
▸ NFKB1 P19838 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ MTOR P42345 1/20 0.46
▸ RAB9A P51151 1/20 0.46

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
SCHEMBL9266828 0.88 ADRA2C (0.51) QPCTKMT2AMEN1ATMLMNA
SCHEMBL9368011 0.84 ADRA2C (0.54) QPCTKMT2AMEN1GAATBXAS1
SCHEMBL8585641 0.82 MEN1 (0.60) QPCTKMT2AMEN1ATMLMNA
SCHEMBL9262602 0.82 MEN1 (0.60) QPCTKMT2AMEN1ATMLMNA
SCHEMBL9262832 0.76 TBXAS1 (0.54) QPCTKMT2AMEN1ATMLMNA
SCHEMBL8537740 0.75 ADRA2A (0.48) KMT2AMEN1CYP2D6
SCHEMBL9869219 0.75 KMT2A (0.51) QPCTKMT2AMEN1ATMLMNA
SCHEMBL9258888 0.74 MEN1 (0.59) KMT2AMEN1TBXAS1TSHRTP53
Hydrochloric Acid SCHEMBL8590994 0.74 KMT2A (0.50) QPCTKMT2AMEN1ATMLMNA
SCHEMBL9082001 0.73 ADRA2A (0.51) KMT2AMEN1CYP2D6

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0274867-A2 Pharmaceutically active compounds SCHERING CORPORATION (US) 1988-07-20 — — EP claimed
US-5750532-A TETRAHYDROPYRIMIDINE-2,4-DIONE DERIVATIVES, VIRICIDES, ANTIINFLAMMATORY AGENTS, PAF INHIBITORS SCHERING CORPORATION (US) 1998-05-12 — — US disclosed
US-5459144-A Enterovirus and rhinovirus antiviral, antiinflammatory and antagonist of platelet activating factor SCHERING CORPORATION (US) 1995-10-17 — — US disclosed
EP-0274867-B1 Pharmaceutically active compounds SCHERING CORP (US) 1994-04-13 — — EP disclosed
US-5272167-A Pharmaceutically active compounds SCHERING CORPORATION (US) 1993-12-21 — — US disclosed
EP-0560407-A1 Pharmaceutically active compounds SCHERING CORPORATION (US) 1993-09-15 — — EP disclosed
WO-1991000858-A1 PHARMACEUTICALLY ACTIVE COMPOUNDS SCHERING CORPORATION (US) 1991-01-24 — — WO disclosed
EP-0407217-A1 Pharmaceutically active compounds SCHERING CORPORATION (US) 1991-01-09 — — EP disclosed
US-4851423-A Pharmaceutically active compounds SCHERING CORPORATION (US) 1989-07-25 — — US disclosed
EP-0274867-A2 Pharmaceutically active compounds SCHERING CORPORATION (US) 1988-07-20 — — EP disclosed
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