SCHEMBL7708750

SCHEMBL7708750

[CH2]CC[CH]c1c2ccccc2cc2ccccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
AMY1A P0DUB6 1/20 0.40
POLB P06746 2/20 0.38
LMNA P02545 1/20 0.38
NR1I2 O75469 1/20 0.37
ALDH1A1 P00352 2/20 0.37
HSD17B10 Q99714 2/20 0.37
HIF1A Q16665 1/20 0.37
CYP1B1 Q16678 1/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
HTT P42858 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
ALOX5 P09917 1/20 0.36
MAOA P21397 2/20 0.36
MAOB P27338 1/20 0.36
KMT2A Q03164 4/20 0.35
MEN1 O00255 3/20 0.35
CYP1A2 P05177 2/20 0.35

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
SCHEMBL7702826 0.89 HTR2A (0.38) HTR2AL3MBTL1AMY1APOLBLMNA
SCHEMBL1610694 0.80 NR1I2 (0.44) HTR2AL3MBTL1AMY1APOLBLMNA
SCHEMBL1610558 0.77 GAA (0.43) HTR2AL3MBTL1AMY1APOLBLMNA
SCHEMBL1613222 0.77 NR1I2 (0.47) HTR2AL3MBTL1AMY1APOLBLMNA
SCHEMBL1611367 0.76 GAA (0.42) HTR2AL3MBTL1AMY1ALMNANR1I2
SCHEMBL1610099 0.74 MAPT (0.44) HTR2AL3MBTL1LMNANR1I2ALDH1A1
SCHEMBL1610935 0.74 MAPT (0.44) HTR2AL3MBTL1LMNANR1I2ALDH1A1
SCHEMBL5477082 0.72 RXRA (0.41) ALDH1A1HSD17B10KDM4E
SCHEMBL27994798 0.72 AMY1A (0.46) HTR2AL3MBTL1AMY1APOLBLMNA
SCHEMBL29948626 0.72 AMY1A (0.46) HTR2AL3MBTL1AMY1APOLBLMNA

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
US-6358665-B1 ONIUM SALT PRECURSOR FOR GENERATING FLUOROALKYLSULFONATE CLARIANT INTERNATIONAL LTD. (CH) 2002-03-19 US disclosed
EP-1033624-A1 RADIATION-SENSITIVE COMPOSITION OF CHEMICAL AMPLIFICATION TYPE Clariant International Ltd. (CH) 2000-09-06 EP disclosed