SCHEMBL30434848

SCHEMBL30434848

CCCc1nn(C)c2c(=O)[nH]c(-c3cc(S(=O)(=O)N4CC(C)NC(C)C4)ccc3OCC)nc12

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE5A O76074 18/20 0.79
▸ PDE3B Q13370 3/20 0.79
▸ PDE3A Q14432 3/20 0.79
▸ PDE2A O00408 1/20 0.79
▸ ABCC4 O15439 1/20 0.79
▸ ABCC5 O15440 1/20 0.79
▸ PDE6D O43924 1/20 0.79
▸ PDE8A O60658 1/20 0.79
▸ PDE9A O76083 1/20 0.79
▸ ABCB11 O95342 1/20 0.79
▸ CYP3A4 P08684 1/20 0.79
▸ HTR1A P08908 1/20 0.79
▸ PDE6A P16499 1/20 0.79
▸ PDE6G P18545 1/20 0.79
▸ PDE4A P27815 1/20 0.79
▸ ADORA2A P29274 1/20 0.79
▸ ADORA1 P30542 1/20 0.79
▸ ADRA1A P35348 1/20 0.79
▸ PDE6B P35913 1/20 0.79
▸ PDE6C P51160 1/20 0.79

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
SCHEMBL25925162 1.00 PDE5A (0.79) PDE5APDE3BPDE3APDE2AABCC4
SCHEMBL6497379 1.00 PDE5A (0.79) PDE5APDE3BPDE3APDE2AABCC4
SCHEMBL6497382 1.00 PDE5A (0.79) PDE5APDE3BPDE3APDE2AABCC4
SCHEMBL29394704 1.00 PDE5A (0.79) PDE5APDE3BPDE3APDE2AABCC4
SCHEMBL28891471 0.95 PDE5A (0.73) PDE5APDE3BPDE3APDE2AABCC4
SCHEMBL14929265 0.92 PDE5A (0.79) PDE5APDE3BPDE3APDE2AABCC4
SCHEMBL5450729 0.92 PDE5A (0.66) PDE5APDE3BPDE3APDE2AABCC4
SCHEMBL5450733 0.92 PDE5A (0.66) PDE5APDE3BPDE3APDE2AABCC4
SCHEMBL5450606 0.92 PDE5A (0.66) PDE5APDE3BPDE3APDE2AABCC4
SCHEMBL5450646 0.92 PDE5A (0.66) PDE5APDE3BPDE3APDE2AABCC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116262118-A Application of alidenafil or salt thereof in preparation of medicines for preventing or treating ischemic brain injury 真奥金银花药业有限公司 2023-06-16 — — CN disclosed
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