SCHEMBL29466733

SCHEMBL29466733

Cc1cccc([I+]c2c(C)cc(C)cc2C)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 4/20 0.44
ALDH1A1 P00352 1/20 0.37
MAPK1 P28482 1/20 0.37
HTR2C P28335 3/20 0.35
CYP1A2 P05177 3/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
CYP2A6 P11509 1/20 0.33
TP53 P04637 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
NPC1 O15118 2/20 0.33
HTR2A P28223 1/20 0.33
SLC6A4 P31645 1/20 0.33
HTR2B P41595 1/20 0.33
SLC6A3 Q01959 1/20 0.33
HPN P05981 1/20 0.33
RAPGEF4 Q8WZA2 1/20 0.32
CASP3 P42574 1/20 0.32

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
Trifluoromethanesulfonic Acid SCHEMBL29462456 0.83 GPR3 (0.41) ACHEMAPK1CYP1A2MEN1KMT2A
SCHEMBL7896739 0.83 CYP1A2 (0.40) ACHECYP1A2CYP2A6TDP1SLC6A4
SCHEMBL29466736 0.82 ALDH1A1 (0.47) ALDH1A1MAPK1HTR2CCYP1A2MEN1
SCHEMBL31477910 0.82 ACHE (0.58) ACHEALDH1A1MAPK1HTR2CCYP1A2
SCHEMBL30951260 0.78 RAPGEF4 (0.50) MAPK1HTR2CCYP1A2MEN1KMT2A
Hydrochloric Acid SCHEMBL31093482 0.77 RAPGEF4 (0.49) MAPK1HTR2CCYP1A2MEN1KMT2A
SCHEMBL29466740 0.76 RAPGEF4 (0.40) ACHEALDH1A1CYP1A2MEN1KMT2A
SCHEMBL4949117 0.74 ACHE (0.48) ACHEALDH1A1MAPK1HTR2CCYP1A2
SCHEMBL29466743 0.74 RAPGEF4 (0.43) ACHEALDH1A1CYP1A2CYP2A6TP53
Hydrochloric Acid SCHEMBL31093485 0.71 RAPGEF4 (0.41) ACHEALDH1A1CYP1A2CYP2A6TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4208500-A1 POLYMERS CONTAINING REPEATING UNITS WITH SEVERAL METAL OR ORGANIC SULPHONATE UNITS, METHODS FOR PREPARING SAME AND USES THEREOF CDP-Innovation (FR) 2023-07-12 EP claimed
WO-2022049236-A1 POLYMERS CONTAINING REPEATING UNITS WITH SEVERAL METAL OR ORGANIC SULPHONATE UNITS, METHODS FOR PREPARING SAME AND USES THEREOF CDP INNOVATION (FR) 2022-03-10 WO claimed
WO-2025094854-A1 METHOD FOR PRODUCING POLYACID SALTS OR MIXTURES THEREOF, AND METHOD FOR REMOVING IMPURITIES 東京応化工業株式会社 2025-05-08 WO disclosed
WO-2025094825-A1 HETEROPOLYOXOMETALATE HAVING MODIFIED LACUNARY SITE, OR MIXTURE THEREOF 東京応化工業株式会社 2025-05-08 WO disclosed
EP-4208500-A1 POLYMERS CONTAINING REPEATING UNITS WITH SEVERAL METAL OR ORGANIC SULPHONATE UNITS, METHODS FOR PREPARING SAME AND USES THEREOF CDP-Innovation (FR) 2023-07-12 EP disclosed
WO-2022049236-A1 POLYMERS CONTAINING REPEATING UNITS WITH SEVERAL METAL OR ORGANIC SULPHONATE UNITS, METHODS FOR PREPARING SAME AND USES THEREOF CDP INNOVATION (FR) 2022-03-10 WO disclosed