SCHEMBL28504001

SCHEMBL28504001

O=C(O)c1cccc(C2=CC3=CC4=NC(=CC5=NC(=CC6=NC(=CC2=N3)C=C6)C=C5)C=C4)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMO O15229 2/20 0.42
▸ RXRA P19793 2/20 0.38
▸ RXRB P28702 2/20 0.38
▸ CD74 P04233 1/20 0.38
▸ MIF P14174 1/20 0.38
▸ KEAP1 Q14145 1/20 0.37
▸ DDT P30046 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ MAP2K4 P45985 1/20 0.36
▸ MAPKAPK3 Q16644 1/20 0.36
▸ MAPK6 Q16659 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ HDAC1 Q13547 1/20 0.35
▸ HDAC6 Q9UBN7 1/20 0.35
▸ NR1H4 Q96RI1 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
SCHEMBL28708315 0.87 — —
SCHEMBL11337785 0.83 BCL2L1 (0.33) RXRARXRBKDM4ENPC1ALDH1A1
SCHEMBL28807790 0.83 BCL2L1 (0.33) RXRARXRBKDM4ENPC1ALDH1A1
SCHEMBL28351381 0.83 BCL2L1 (0.33) RXRARXRBKDM4ENPC1ALDH1A1
SCHEMBL28332937 0.83 BCL2L1 (0.33) RXRARXRBKDM4ENPC1ALDH1A1
SCHEMBL473159 0.80 MAOA (0.32) —
SCHEMBL28754048 0.80 IDO1 (0.33) —
SCHEMBL28741713 0.79 MAOA (0.31) —
Hydrochloric Acid SCHEMBL28432953 0.79 MAOA (0.31) —
SCHEMBL28379974 0.79 MAOA (0.31) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113555564-B Preparation of supported non-noble metal electrocatalyst with MIL-88 as carrier and application of supported non-noble metal electrocatalyst in oxygen reduction reaction 大连民族大学 2023-06-20 — — CN claimed
CN-113555564-A Preparation of supported non-noble metal electrocatalyst with MIL-88 as carrier and application of supported non-noble metal electrocatalyst in oxygen reduction reaction 大连民族大学 2021-10-26 — — CN claimed
CN-118063477-A Meso-tetra (5-carboxyfuranyl) porphyrin and synthesis method thereof 南开大学 2024-05-24 — — CN disclosed
CN-112094214-A Method for synthesizing cumene hydroperoxide by catalyzing and oxidizing cumene with nickel (II) porphyrin 浙江工业大学 2020-12-18 — — CN disclosed
CN-111995556-A Method for synthesizing cumene hydroperoxide by catalytic oxidation of cumene with copper (II) porphyrin 浙江工业大学 2020-11-27 — — CN disclosed
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