SCHEMBL9208121

SCHEMBL9208121

CCOC(=O)c1cc2c(=O)c3cc(CC)ccc3oc2nc1C

nearest known ligand 0.81

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 9/20 0.81
▸ NPC1 O15118 8/20 0.81
▸ RXFP1 Q9HBX9 2/20 0.81
▸ TBK1 Q9UHD2 6/20 0.64
▸ KDM4E B2RXH2 4/20 0.58
▸ ALDH1A1 P00352 3/20 0.58
▸ SMN1; SMN2 Q16637 3/20 0.58
▸ PKM P14618 1/20 0.58
▸ HPGD P15428 1/20 0.58
▸ MAPT P10636 1/20 0.58
▸ HSD17B10 Q99714 1/20 0.58
▸ KMT2A Q03164 5/20 0.56
▸ MEN1 O00255 4/20 0.56
▸ POLB P06746 1/20 0.55
▸ IKBKE Q14164 2/20 0.50

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
SCHEMBL9205610 0.90 RAB9A (0.66) RAB9ANPC1RXFP1TBK1KDM4E
SCHEMBL9204045 0.89 RAB9A (0.65) RAB9ANPC1RXFP1TBK1KDM4E
SCHEMBL11110654 0.86 RAB9A (0.61) RAB9ANPC1RXFP1TBK1KDM4E
SCHEMBL9214814 0.86 RAB9A (1.00) RAB9ANPC1RXFP1TBK1KDM4E
SCHEMBL10987502 0.84 TBK1 (0.60) RAB9ANPC1RXFP1TBK1KDM4E
SCHEMBL10823671 0.84 RAB9A (0.58) RAB9ANPC1RXFP1TBK1KDM4E
SCHEMBL10991723 0.84 RAB9A (0.58) RAB9ANPC1RXFP1TBK1KDM4E
SCHEMBL10993475 0.83 TBK1 (0.61) RAB9ANPC1RXFP1TBK1KDM4E
SCHEMBL10993477 0.82 RAB9A (0.56) RAB9ANPC1RXFP1TBK1KDM4E
SCHEMBL19196856 0.82 TBK1 (0.82) RAB9ANPC1RXFP1TBK1KDM4E

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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