SCHEMBL28061261

SCHEMBL28061261

c1c[nH]nn1.c1c[nH]nn1.c1c[nH]nn1.c1c[nH]nn1.c1ccc(C(=C(c2ccccc2)c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ SNCA P37840 2/20 0.32
▸ F2 P00734 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ ESR1 P03372 2/20 0.32
▸ CYP19A1 P11511 2/20 0.32
▸ ESR2 Q92731 1/20 0.32
▸ ALDH1A1 P00352 2/20 0.31
▸ TSHR P16473 2/20 0.31
▸ CES2 O00748 2/20 0.31
▸ CES1 P23141 2/20 0.31
▸ DAO P14920 1/20 0.31
▸ NAPRT Q6XQN6 1/20 0.31
▸ PLOD2 O00469 1/20 0.31
▸ PLOD3 O60568 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ CYP2D6 P10635 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31

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
SCHEMBL27970673 1.00 KMT2A (0.33) KMT2AMEN1SNCAF2LMNA
SCHEMBL28016232 0.98 MEN1 (0.32) KMT2AMEN1SNCAF2LMNA
Bromide SCHEMBL28825975 0.96 SNCA (0.33) KMT2AMEN1SNCAF2LMNA
SCHEMBL28069546 0.93 — —
SCHEMBL28295478 0.91 — —
Zinc Ion SCHEMBL28819502 0.88 CES2 (0.34) KMT2AMEN1F2LMNAESR2
Terephthalic Acid SCHEMBL28067237 0.88 TSHR (0.45) ALDH1A1TSHRCES2CES1DAO
Acetic Acid SCHEMBL28062766 0.87 CA2 (0.36) KMT2AMEN1F2LMNAESR1
Terephthalic Acid SCHEMBL28007787 0.85 CA2 (0.47) KMT2AMEN1CES2CES1
Benzophenone SCHEMBL27762502 0.84 ALDH1A1 (0.54) KMT2AMEN1LMNAALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109867634-B Strong fluorescence emission cage-shaped metal compound and synthetic method thereof 西北大学 2021-10-15 — — CN claimed
CN-110551073-A strong fluorescence emission capsule-shaped metal nitrogen heterocyclic carbene compound and synthetic method thereof UNIV NORTHWESTERN 2019-12-10 — — CN claimed
CN-109867634-B Strong fluorescence emission cage-shaped metal compound and synthetic method thereof 西北大学 2021-10-15 — — CN disclosed
CN-110551073-B Strong fluorescence emission capsule-shaped metal nitrogen heterocyclic carbene compound and synthetic method thereof 西北大学 2021-10-15 — — CN disclosed
CN-110551073-A strong fluorescence emission capsule-shaped metal nitrogen heterocyclic carbene compound and synthetic method thereof UNIV NORTHWESTERN 2019-12-10 — — CN disclosed
CN-105622648-A Tetraphenyl ethylene tetra-triazole included methanol zinc perchlorate complex with potential fluorescent material and preparation method thereof UNIV TIANJIN 2016-06-01 — — CN disclosed
CN-105566360-A Tetraphenyl ethylene tetra(triazole) inclusion dimethyl acetamide cadmium complex and preparation method thereof UNIV TIANJIN 2016-05-11 — — CN disclosed
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