SCHEMBL9262832

SCHEMBL9262832

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

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TBXAS1 P24557 4/20 0.54
▸ QPCT Q16769 3/20 0.53
▸ ALDH1A1 P00352 2/20 0.50
▸ MEN1 O00255 2/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ MAPT P10636 2/20 0.50
▸ TSHR P16473 1/20 0.50
▸ ATM Q13315 1/20 0.50
▸ LMNA P02545 1/20 0.49
▸ NPC1 O15118 1/20 0.49
▸ RAB9A P51151 1/20 0.49
▸ GAA P10253 1/20 0.48

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
SCHEMBL9267886 0.88 TBXAS1 (0.53) TBXAS1ALDH1A1MEN1KMT2AMAPT
SCHEMBL9264092 0.82 TBXAS1 (0.70) TBXAS1QPCTALDH1A1MEN1KMT2A
SCHEMBL9266704 0.82 TBXAS1 (0.70) TBXAS1QPCTALDH1A1MEN1KMT2A
SCHEMBL8540598 0.76 QPCT (0.53) TBXAS1QPCTALDH1A1MEN1KMT2A
SCHEMBL8537739 0.76 RAB9A (0.56) ALDH1A1MEN1KMT2AMAPTTSHR
SCHEMBL8571284 0.74 RAB9A (0.58) ALDH1A1MEN1KMT2AMAPTLMNA
SCHEMBL14930210 0.74 PDE4B (0.62) ALDH1A1MEN1KMT2AMAPTLMNA
SCHEMBL15076021 0.74 THRA (0.61) MEN1KMT2AMAPTLMNANPC1
SCHEMBL10788695 0.74 SMN1; SMN2 (0.61) ALDH1A1MEN1KMT2AMAPTLMNA
SCHEMBL21480338 0.73 RAB9A (0.59) ALDH1A1MEN1KMT2AMAPTLMNA

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 8 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-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
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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