SCHEMBL9214814

SCHEMBL9214814

CCOC(=O)c1cc2c(=O)c3ccccc3oc2nc1C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 8/20 1.00
▸ NPC1 O15118 7/20 0.78
▸ RXFP1 Q9HBX9 1/20 0.77
▸ KMT2A Q03164 6/20 0.72
▸ MEN1 O00255 5/20 0.72
▸ KDM4E B2RXH2 6/20 0.62
▸ RECQL P46063 1/20 0.62
▸ TBK1 Q9UHD2 3/20 0.59
▸ ALDH1A1 P00352 4/20 0.56
▸ GLA P06280 1/20 0.56
▸ GAA P10253 1/20 0.56
▸ MAOB P27338 1/20 0.55
▸ SMN1; SMN2 Q16637 2/20 0.54
▸ PKM P14618 1/20 0.54
▸ HPGD P15428 1/20 0.54
▸ MAPT P10636 1/20 0.54
▸ HSD17B10 Q99714 1/20 0.54
▸ POLB P06746 2/20 0.53
▸ L3MBTL1 Q9Y468 1/20 0.51

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
SCHEMBL9208121 0.86 RAB9A (0.81) RAB9ANPC1RXFP1KMT2AMEN1
SCHEMBL11102499 0.84 RAB9A (0.72) RAB9ANPC1RXFP1KMT2AMEN1
SCHEMBL11102495 0.84 RAB9A (0.72) RAB9ANPC1RXFP1KMT2AMEN1
SCHEMBL17072179 0.84 KMT2A (0.81) RAB9ANPC1RXFP1KMT2AMEN1
SCHEMBL10992370 0.82 RAB9A (0.69) RAB9ANPC1RXFP1KMT2AMEN1
SCHEMBL10992374 0.81 RAB9A (0.68) RAB9ANPC1RXFP1KMT2AMEN1
SCHEMBL19182246 0.76 TBK1 (0.74) RAB9ANPC1RXFP1KDM4ETBK1
SCHEMBL9213416 0.76 KMT2A (0.68) RAB9ANPC1RXFP1KMT2AMEN1
SCHEMBL9205610 0.76 RAB9A (0.66) RAB9ANPC1RXFP1KMT2AMEN1
SCHEMBL19196789 0.76 TBK1 (0.80) RAB9ANPC1RXFP1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0561845-B1 PYRIDO-ANELLATED 4-OXO-4H-BENZOPYRANS, A METHOD OF PREPARING THEM, AND THEIR USE AS ANTIDOTES BASF AG (DE) 1995-03-08 — — EP claimed
EP-0561845-A1 PYRIDO-ANELLATED 4-OXO-4H-BENZOPYRANS, A METHOD OF PREPARING THEM, AND THEIR USE AS ANTIDOTES. BASF AG (DE) 1993-09-29 — — EP claimed
WO-1992010500-A1 PYRIDO-ANELLATED 4-OXO-4H-BENZOPYRANS, A METHOD OF PREPARING THEM, AND THEIR USE AS ANTIDOTES BASF AKTIENGESELLSCHAFT (DE) 1992-06-25 — — WO claimed
EP-0561845-B1 PYRIDO-ANELLATED 4-OXO-4H-BENZOPYRANS, A METHOD OF PREPARING THEM, AND THEIR USE AS ANTIDOTES BASF AG (DE) 1995-03-08 — — EP disclosed
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