SCHEMBL11362855

SCHEMBL11362855

CCc1ccc2oc3cc(C(=O)O)c(C)nc3c(=O)c2c1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 8/20 0.51
▸ NPC1 O15118 6/20 0.51
▸ SMN1; SMN2 Q16637 3/20 0.51
▸ KDM4E B2RXH2 3/20 0.51
▸ ALDH1A1 P00352 2/20 0.51
▸ PKM P14618 1/20 0.51
▸ HPGD P15428 1/20 0.51
▸ MEN1 O00255 3/20 0.49
▸ KMT2A Q03164 3/20 0.49
▸ TBK1 Q9UHD2 5/20 0.44
▸ IKBKE Q14164 2/20 0.44
▸ RXFP1 Q9HBX9 2/20 0.44
▸ POLB P06746 2/20 0.41
▸ MAPT P10636 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40

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
SCHEMBL10823671 0.88 RAB9A (0.58) RAB9ANPC1KDM4EALDH1A1HPGD
SCHEMBL11364300 0.88 TBK1 (0.47) RAB9ANPC1SMN1; SMN2KDM4EALDH1A1
SCHEMBL11374157 0.88 TBK1 (0.44) RAB9ANPC1SMN1; SMN2KDM4EALDH1A1
SCHEMBL11098702 0.87 TBK1 (0.43) RAB9ANPC1SMN1; SMN2KDM4EALDH1A1
SCHEMBL2907432 0.87 TBK1 (0.56) RAB9ANPC1KDM4EPKMTBK1
SCHEMBL11369213 0.85 TBK1 (0.42) RAB9ANPC1SMN1; SMN2KDM4EALDH1A1
SCHEMBL11359964 0.85 TBK1 (0.42) RAB9ANPC1SMN1; SMN2KDM4EALDH1A1
SCHEMBL11550983 0.84 POLB (0.43) RAB9ANPC1SMN1; SMN2KDM4EALDH1A1
SCHEMBL11549501 0.83 MEN1 (0.70) RAB9ANPC1SMN1; SMN2KDM4EALDH1A1
SCHEMBL11544400 0.81 MEN1 (0.68) RAB9ANPC1SMN1; SMN2KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4143042-A ANTIALLERGENS, BRONCHODILATOR AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1979-03-06 — — US claimed
US-4299963-A ANTIALLERGENS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1981-11-10 — — US disclosed
US-4255576-A 1-Azaxanthone derivatives TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1981-03-10 — — US disclosed
US-4143042-A ANTIALLERGENS, BRONCHODILATOR AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1979-03-06 — — US disclosed
JP-S06110588-A — — 0001-01-01 — — JP disclosed
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