SCHEMBL9626856

SCHEMBL9626856

CC1CCc2c(ccc3[nH]c(=O)ccc23)O1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 4/20 0.50
▸ ALDH1A1 P00352 2/20 0.39
▸ MAPT P10636 1/20 0.39
▸ CYP1A2 P05177 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ ALPG P10696 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ CA1 P00915 1/20 0.36
▸ CA9 Q16790 1/20 0.36
▸ PDE3B Q13370 6/20 0.36
▸ PDE3A Q14432 6/20 0.36
▸ LMNA P02545 1/20 0.35
▸ AR P10275 3/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ MEN1 O00255 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ NQO2 P16083 1/20 0.31

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
SCHEMBL9096470 0.85 HPGD (0.50) HPGDALDH1A1MAPTSMN1; SMN2PDE3B
SCHEMBL9628449 0.72 HTR2A (0.41) HPGDALDH1A1MAPTCA1CA9
SCHEMBL9626684 0.71 PDE4D (0.41) HPGDMAPTPDE3BPDE3ALMNA
SCHEMBL9096832 0.70 PDE3B (0.38) HPGDALDH1A1CYP1A2CYP2D6ALPG
SCHEMBL9095629 0.70 PDE3B (0.34) HPGDALDH1A1MAPTCYP1A2CYP2D6
SCHEMBL9097597 0.67 PDE3B (0.33) HPGDPDE3BPDE3ALMNA
SCHEMBL9626996 0.67 KDM4E (0.50) HPGDALDH1A1MAPTPDE3BPDE3A
SCHEMBL9626626 0.66 PDE3B (0.33) CA1CA9PDE3BPDE3AKDM4E
SCHEMBL9627284 0.64 MAP3K14 (0.42) ALDH1A1CA1CA9PDE3BPDE3A
SCHEMBL13443211 0.63 HPGD (0.40) HPGDALDH1A1MAPTCA1CA9

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-5093339-A Anticoagulant, hypotensive, antiangina, antiasthma, antiulcer, anti-platelet activating factor KODAMA KABUSHIKI KAISHA (JP) 1992-03-03 — — US disclosed
EP-0355689-A2 Pyrano [f] quinoline derivatives and pharmaceutical compositions containing the same KODAMA KABUSHIKI KAISHA (JP) 1990-02-28 — — EP disclosed
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