SCHEMBL11364824

SCHEMBL11364824

CCOC(=O)c1cc2oc3ccc(CC)cc3c(=O)c2nc1-c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 2/20 0.46
▸ ALDH1A1 P00352 8/20 0.46
▸ KDM4E B2RXH2 8/20 0.46
▸ GAA P10253 2/20 0.46
▸ GLA P06280 1/20 0.46
▸ LMNA P02545 3/20 0.46
▸ MAPT P10636 2/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ ATM Q13315 1/20 0.46
▸ NPC1 O15118 1/20 0.45
▸ RXFP1 Q9HBX9 1/20 0.45
▸ TBK1 Q9UHD2 1/20 0.45
▸ L3MBTL1 Q9Y468 6/20 0.45
▸ TDP1 Q9NUW8 4/20 0.45
▸ HTT P42858 1/20 0.44
▸ GPR55 Q9Y2T6 1/20 0.44
▸ CCNB2 O95067 1/20 0.43
▸ CDK1 P06493 1/20 0.43
▸ CCNB1 P14635 1/20 0.43

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
SCHEMBL11550983 0.90 POLB (0.43) RAB9AALDH1A1KDM4ELMNAMAPT
SCHEMBL10823671 0.85 RAB9A (0.58) RAB9AALDH1A1KDM4EGAAGLA
SCHEMBL11357243 0.84 RAB9A (0.49) RAB9AALDH1A1KDM4EGAAGLA
SCHEMBL11366885 0.84 RAB9A (0.49) RAB9AALDH1A1KDM4EGAAGLA
SCHEMBL11357935 0.83 RAB9A (0.48) RAB9AALDH1A1KDM4EGAAGLA
SCHEMBL11361695 0.83 TBK1 (0.60) RAB9AALDH1A1KDM4EGAAGLA
SCHEMBL11362140 0.82 RAB9A (0.47) RAB9AALDH1A1KDM4EGAAGLA
SCHEMBL11368720 0.82 RAB9A (0.47) RAB9AALDH1A1KDM4EGAAGLA
SCHEMBL11362855 0.79 RAB9A (0.51) RAB9AALDH1A1KDM4EMAPTSMN1; SMN2
SCHEMBL11397722 0.77 RAB9A (0.45) RAB9AALDH1A1KDM4EGAAGLA

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
US-4299963-A ANTIALLERGENS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1981-11-10 — — 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
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