SCHEMBL28874964

SCHEMBL28874964

NC(=O)NN=Cc1ccc2ccccc2c1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.72
▸ HTT P42858 1/20 0.72
▸ ESR1 P03372 1/20 0.63
▸ ESRRG P62508 1/20 0.63
▸ ESR2 Q92731 1/20 0.63
▸ KDM4E B2RXH2 3/20 0.58
▸ MEN1 O00255 3/20 0.58
▸ KMT2A Q03164 3/20 0.58
▸ ALDH1A1 P00352 2/20 0.58
▸ HPGD P15428 1/20 0.58
▸ SMN1; SMN2 Q16637 1/20 0.58
▸ DNM1 Q05193 2/20 0.57
▸ GRIN2D O15399 2/20 0.55
▸ GRIN3B O60391 2/20 0.55
▸ GRIN1 Q05586 2/20 0.55
▸ GRIN2A Q12879 2/20 0.55
▸ GRIN2B Q13224 2/20 0.55
▸ GRIN2C Q14957 2/20 0.55
▸ GRIN3A Q8TCU5 2/20 0.55
▸ FAAH O00519 1/20 0.55

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
SCHEMBL4122644 0.85 ESR1 (0.65) LMNAHTTESR1ESRRGESR2
SCHEMBL4122642 0.85 ESR1 (0.65) LMNAHTTESR1ESRRGESR2
SCHEMBL13779423 0.84 LMNA (0.72) LMNAHTTESR1ESRRGESR2
SCHEMBL21519402 0.84 HTT (1.00) LMNAHTTKDM4EMAPT
Acetic Acid SCHEMBL21519481 0.83 LMNA (0.62) LMNAHTTESR1ESRRGESR2
SCHEMBL28437518 0.83 ESR1 (0.62) LMNAHTTESR1ESRRGESR2
SCHEMBL13569020 0.83 ESR1 (0.89) LMNAHTTESR1ESRRGESR2
SCHEMBL28431011 0.83 ESR1 (0.62) LMNAHTTESR1ESRRGESR2
Hydrochloric Acid SCHEMBL5703006 0.83 LMNA (0.70) LMNAHTTESR1ESRRGESR2
Hydrochloric Acid SCHEMBL9618640 0.83 LMNA (0.70) LMNAHTTESR1ESRRGESR2

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-109884224-A Carbazochrome sodium sulfonate and method for measuring content of semicarbazide hydrochloride in preparation thereof 四川联成迅康医药股份有限公司 2019-06-14 — — CN claimed
CN-109884224-A Carbazochrome sodium sulfonate and method for measuring content of semicarbazide hydrochloride in preparation thereof 四川联成迅康医药股份有限公司 2019-06-14 — — CN disclosed
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