SCHEMBL28476967

SCHEMBL28476967

CC(=O)Nc1ccc(-c2c3nc(c(-c4cc(C(C)(C)C)cc(C(C)(C)C)c4)c4ccc(cc5nc(c(-c6cc(C(C)(C)C)cc(C(C)(C)C)c6)c6ccc2[nH]6)C=C5)[nH]4)C=C3)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.46
▸ STAT1 P42224 1/20 0.46
▸ TOP1 P11387 3/20 0.41
▸ CYCS P99999 4/20 0.40
▸ ABCG2 Q9UNQ0 1/20 0.40
▸ KDM4E B2RXH2 4/20 0.37
▸ ALDH1A1 P00352 3/20 0.37
▸ HPGD P15428 3/20 0.37
▸ TP53 P04637 3/20 0.37
▸ KMT2A Q03164 3/20 0.37
▸ HSD17B10 Q99714 2/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ ENPP2 Q13822 1/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ MTNR1A P48039 1/20 0.35
▸ MTNR1B P49286 1/20 0.35
▸ DHODH Q02127 1/20 0.35

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
SCHEMBL4260277 0.86 STAT3 (0.56) STAT3STAT1TOP1CYCSABCG2
SCHEMBL4271671 0.85 STAT3 (0.46) STAT3STAT1TOP1CYCSABCG2
SCHEMBL4261963 0.85 STAT3 (0.55) STAT3STAT1TOP1CYCSABCG2
SCHEMBL4260943 0.84 STAT3 (0.45) STAT3STAT1TOP1CYCSABCG2
SCHEMBL2790794 0.84 STAT3 (0.47) STAT3STAT1TOP1CYCSABCG2
SCHEMBL12987775 0.84 STAT3 (0.59) STAT3STAT1TOP1CYCSABCG2
SCHEMBL28466363 0.83 STAT3 (0.52) STAT3STAT1TOP1CYCSABCG2
SCHEMBL30527240 0.83 STAT3 (0.67) STAT3STAT1TOP1CYCSABCG2
SCHEMBL31127548 0.82 STAT3 (0.58) STAT3STAT1TOP1CYCSABCG2
SCHEMBL31127544 0.82 STAT3 (0.58) STAT3STAT1TOP1CYCSABCG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112094277-B Triple fused porphyrin dimer covalent functionalized single-walled carbon nanotube nonlinear nano hybrid material and preparation thereof 同济大学 2021-10-08 — — CN claimed
CN-111825684-B Modifiable hyperconjugated triple fused porphyrin dimer strong two-photon absorption material and preparation thereof 同济大学 2021-10-08 — — CN claimed
CN-112094277-A Triple fused porphyrin dimer covalent functionalized single-walled carbon nanotube nonlinear nano hybrid material and preparation thereof 同济大学 2020-12-18 — — CN claimed
CN-111825684-A Modifiable hyperconjugated triple fused porphyrin dimer strong two-photon absorption material and preparation thereof 同济大学 2020-10-27 — — CN claimed
CN-112094277-B Triple fused porphyrin dimer covalent functionalized single-walled carbon nanotube nonlinear nano hybrid material and preparation thereof 同济大学 2021-10-08 — — CN disclosed
CN-111825684-B Modifiable hyperconjugated triple fused porphyrin dimer strong two-photon absorption material and preparation thereof 同济大学 2021-10-08 — — CN disclosed
CN-112094277-A Triple fused porphyrin dimer covalent functionalized single-walled carbon nanotube nonlinear nano hybrid material and preparation thereof 同济大学 2020-12-18 — — CN disclosed
CN-111825684-A Modifiable hyperconjugated triple fused porphyrin dimer strong two-photon absorption material and preparation thereof 同济大学 2020-10-27 — — CN disclosed
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