SCHEMBL9096470

SCHEMBL9096470

CC1Cc2c(ccc3[nH]c(=O)ccc23)O1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 3/20 0.50
▸ ALDH1A1 P00352 2/20 0.50
▸ MAPT P10636 1/20 0.50
▸ KDM4E B2RXH2 1/20 0.44
▸ BRD4 O60885 3/20 0.38
▸ CREBBP Q92793 3/20 0.38
▸ PDE3B Q13370 5/20 0.37
▸ PDE3A Q14432 5/20 0.37
▸ PBRM1 Q86U86 1/20 0.37
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ AR P10275 1/20 0.36
▸ MAOA P21397 3/20 0.36
▸ TDP1 Q9NUW8 1/20 0.34
▸ MAOB P27338 2/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL9626856 0.85 HPGD (0.50) HPGDALDH1A1MAPTKDM4EPDE3B
SCHEMBL9095629 0.78 PDE3B (0.34) HPGDALDH1A1MAPTPDE3BPDE3A
SCHEMBL9626626 0.77 PDE3B (0.33) KDM4EPDE3BPDE3A
SCHEMBL9626996 0.74 KDM4E (0.50) HPGDALDH1A1MAPTKDM4EPDE3B
SCHEMBL9097597 0.74 PDE3B (0.33) HPGDPDE3BPDE3A
SCHEMBL9245586 0.71 HTR1A (0.33) HPGDALDH1A1MAPTKDM4EPDE3B
SCHEMBL9628449 0.71 HTR2A (0.41) HPGDALDH1A1MAPTKDM4EPDE3B
SCHEMBL9626684 0.68 PDE4D (0.41) HPGDMAPTPDE3BPDE3A
SCHEMBL12203811 0.66 NISCH (0.50) HPGDALDH1A1MAPTKDM4EMEN1
SCHEMBL8122273 0.65 ALDH1A1 (0.44) HPGDALDH1A1MAPTKDM4EBRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5576324-A Quinoline derivatives or salt thereof and remedy for cardiac diseases containing the same KOWA CO., LTD. (JP) 1996-11-19 — — US disclosed
EP-0638571-A1 QUINOLINE DERIVATIVE OR SALT THEREOF AND REMEDY FOR CARDIAC DISEASES CONTAINING THE SAME KOWA CO. LTD. (JP) 1995-02-15 — — EP disclosed
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