SCHEMBL10973513

SCHEMBL10973513

CC(=O)Nc1ccc2c(c1)sc(C=CN(C)c1ccccc1)[n+]2C.Cc1ccc(S(=O)(=O)[O-])cc1

nearest known ligand 0.40

Known targets — ChEMBL curated mechanism

CHRM1CHRM2CHRM3CHRM4CHRM5SLC6A2dacAdacBdacCftsImrcAmrcBmrdA

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 3/20 0.40
▸ MAPT P10636 4/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ INSR P06213 2/20 0.39
▸ ALDH1A1 P00352 5/20 0.38
▸ LMNA P02545 4/20 0.38
▸ SMN1; SMN2 Q16637 3/20 0.38
▸ HTT P42858 3/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ HPGD P15428 1/20 0.38
▸ PKM P14618 2/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.35
▸ USP2 O75604 1/20 0.35
▸ GAA P10253 2/20 0.35
▸ IDO1 P14902 1/20 0.34

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
SCHEMBL10973508 1.00 TSHR (0.40) TSHRMAPTMEN1KMT2AINSR
SCHEMBL11323066 0.85 ADRB2 (0.50) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL10974237 0.83 INSR (0.46) MAPTMEN1KMT2AINSRALDH1A1
SCHEMBL10974234 0.83 INSR (0.46) MAPTMEN1KMT2AINSRALDH1A1
SCHEMBL10973680 0.79 MAPT (0.49) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL13646920 0.78 KMT2A (0.51) MAPTMEN1KMT2AINSRALDH1A1
Hydrochloric Acid SCHEMBL11513903 0.77 INSR (0.40) MAPTMEN1KMT2AINSRALDH1A1
SCHEMBL5477938 0.76 ALDH1A1 (0.51) MAPTMEN1KMT2AINSRALDH1A1
Bromide SCHEMBL11311515 0.75 INSR (0.39) MAPTMEN1KMT2AINSRALDH1A1
Bromide SCHEMBL10974485 0.73 ALDH1A1 (0.43) MAPTMEN1KMT2AINSRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0050558-B1 PHOTOGRAPHIC EMULSIONS AND ELEMENTS CAPABLE OF FORMING DIRECT-POSITIVE IMAGES EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1985-07-17 — — EP claimed
EP-0050558-B1 PHOTOGRAPHIC EMULSIONS AND ELEMENTS CAPABLE OF FORMING DIRECT-POSITIVE IMAGES EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1985-07-17 — — EP disclosed
EP-0050558-A2 Photographic emulsions and elements capable of forming direct-positive images EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1982-04-28 — — EP disclosed
US-4306016-A HETEROCYCLIC CYANINE DYE-LIKE NUCLEATING AGENTS EASTMAN KODAK COMPANY (US) 1981-12-15 — — US disclosed
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