SCHEMBL30733299

SCHEMBL30733299

CCCCCCOc1cccc(OCCCCCC)c1-c1c2nc(c(Br)c3ccc([nH]3)c(-c3c(OCCCCCC)cccc3OCCCCCC)c3nc(c(Br)c4ccc1[nH]4)C=C3)C=C2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE5A O76074 4/20 0.40
▸ PDE4A P27815 3/20 0.40
▸ PDE4B Q07343 3/20 0.40
▸ PDE4C Q08493 3/20 0.40
▸ PDE4D Q08499 3/20 0.40
▸ MCHR1 Q99705 3/20 0.40
▸ TERT O14746 2/20 0.36
▸ TLR8 Q9NR97 1/20 0.35
▸ MEN1 O00255 1/20 0.34
▸ NR1I2 O75469 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ CHRM2 P08172 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ ADRA2A P08913 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ OPRK1 P41145 1/20 0.34
▸ HTR2B P41595 1/20 0.34
▸ SLC6A3 Q01959 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ HDAC6 Q9UBN7 1/20 0.34

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
SCHEMBL30733272 0.85 MCHR1 (0.35) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL15298527 0.83 PDE5A (0.32) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL1308810 0.81 PDE5A (0.54) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL28702500 0.81 TERT (0.40) TERTCYP3A4MAPT
SCHEMBL29397238 0.81 TERT (0.40) TERTCYP3A4MAPT
SCHEMBL30733335 0.80 STAT3 (0.47) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL30733261 0.78 MCHR1 (0.38) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL29140523 0.76 PDE5A (0.37) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL1200683 0.76 TERT (0.44) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL1199983 0.76 TERT (0.44) PDE5APDE4APDE4BPDE4CPDE4D

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-117425361-A Porphyrin passivation perovskite nano film material and preparation and application thereof 同济大学 2024-01-19 — — CN disclosed
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