SCHEMBL28418538

SCHEMBL28418538

CCCCOc1c(OC)cc(-c2cc3cc4nc(cc5ccc(cc6nc(cc2[nH]3)C=C6)[nH]5)C=C4)cc1OC

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 1/20 0.35
▸ HRH3 Q9Y5N1 1/20 0.35
▸ TUBB4A P04350 1/20 0.35
▸ TUBB P07437 1/20 0.35
▸ TUBA3C P0DPH7 1/20 0.35
▸ TUBA1B P68363 1/20 0.35
▸ TUBA4A P68366 1/20 0.35
▸ TUBB4B P68371 1/20 0.35
▸ TUBB3 Q13509 1/20 0.35
▸ TUBB2A Q13885 1/20 0.35
▸ TUBB8 Q3ZCM7 1/20 0.35
▸ TUBA3E Q6PEY2 1/20 0.35
▸ TUBA1A Q71U36 1/20 0.35
▸ TUBA1C Q9BQE3 1/20 0.35
▸ TUBB6 Q9BUF5 1/20 0.35
▸ TUBB2B Q9BVA1 1/20 0.35
▸ TUBB1 Q9H4B7 1/20 0.35
▸ SRC P12931 1/20 0.35
▸ BRD4 O60885 3/20 0.34
▸ SMPD3 Q9NY59 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
SCHEMBL2950385 0.87 BRD4 (0.40) BRD4SMN1; SMN2MEN1KMT2A
SCHEMBL29148788 0.81 AMY1A (0.43) SMPD3
SCHEMBL28436254 0.81 HPGD (0.41) SMN1; SMN2
SCHEMBL28839762 0.81 PLA2G2A (0.36) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL28493239 0.81 HPGD (0.41) SMN1; SMN2
SCHEMBL2951395 0.80 ALOX5 (0.43) PDE4ASMN1; SMN2MEN1KMT2A
SCHEMBL29901368 0.79 PDE5A (0.48) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL2942313 0.77 ABL1 (0.36) SMPD3SMN1; SMN2
SCHEMBL9590022 0.77 NPC1 (0.40) SMPD3SMN1; SMN2MEN1KMT2A
SCHEMBL5576187 0.77 NOX1 (0.46) SMPD3

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
CN-111349102-A D-pi-A zinc porphyrin complex, synthesis thereof and application thereof in preparation of dye-sensitized solar cell 西北师范大学 2020-06-30 — — CN claimed
CN-111349102-A D-pi-A zinc porphyrin complex, synthesis thereof and application thereof in preparation of dye-sensitized solar cell 西北师范大学 2020-06-30 — — CN disclosed
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