SCHEMBL28016232

SCHEMBL28016232

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

nearest known ligand 0.32

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ SNCA P37840 2/20 0.32
▸ F2 P00734 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ ESR1 P03372 2/20 0.31
▸ CYP19A1 P11511 1/20 0.31
▸ ESR2 Q92731 1/20 0.31
▸ DAO P14920 1/20 0.30
▸ TSHR P16473 1/20 0.30
▸ NAPRT Q6XQN6 1/20 0.30
▸ CES2 O00748 1/20 0.30
▸ CES1 P23141 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30

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
SCHEMBL28061261 0.98 KMT2A (0.33) MEN1KMT2ASNCAF2LMNA
SCHEMBL27970673 0.98 KMT2A (0.33) MEN1KMT2ASNCAF2LMNA
Bromide SCHEMBL28825975 0.94 SNCA (0.33) MEN1KMT2ASNCAF2LMNA
SCHEMBL28069546 0.91 — —
SCHEMBL28295478 0.89 — —
Zinc Ion SCHEMBL28819502 0.86 CES2 (0.34) MEN1KMT2AF2LMNAESR2
Terephthalic Acid SCHEMBL28067237 0.86 TSHR (0.45) DAOTSHRNAPRTCES2CES1
Acetic Acid SCHEMBL28062766 0.85 CA2 (0.36) MEN1KMT2AF2LMNAESR1
Terephthalic Acid SCHEMBL28056588 0.84 CA2 (0.47) MEN1KMT2ACES2CES1
Benzophenone SCHEMBL27762502 0.82 ALDH1A1 (0.54) MEN1KMT2ALMNAALDH1A1

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-104628752-A Tetraphenyl ethylene tetratriazole cadmium complex with potential fluorescent material and preparation method thereof UNIV TIANJIN NORMAL 2015-05-20 — — CN disclosed
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