SCHEMBL7708248

SCHEMBL7708248

[CH2]CCC[CH]c1ccc(C)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 1/20 0.44
RAB9A P51151 3/20 0.38
NPC1 O15118 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NFE2L2 Q16236 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
ACHE P22303 1/20 0.35
KDM4E B2RXH2 2/20 0.33
MAPT P10636 2/20 0.33
RELA Q04206 1/20 0.33
POLB P06746 1/20 0.33
RECQL P46063 1/20 0.33
MDM2 Q00987 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CA1 P00915 1/20 0.33
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
FBP1 P09467 1/20 0.31

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
SCHEMBL5469370 0.86 CYP2A6 (0.48) CYP2A6RAB9ANPC1SMN1; SMN2NFE2L2
SCHEMBL1612718 0.80 CYP2A6 (0.46) CYP2A6RAB9ANPC1SMN1; SMN2NFE2L2
SCHEMBL28594086 0.79 NFE2L2 (0.42) CYP2A6RAB9ANPC1SMN1; SMN2NFE2L2
SCHEMBL1610243 0.78 CYP2A6 (0.44) CYP2A6RAB9ANPC1SMN1; SMN2NFE2L2
SCHEMBL7702823 0.78 ALDH5A1 (0.44) RAB9ANPC1SMN1; SMN2NFE2L2TDP1
SCHEMBL7708213 0.78 HSD17B10 (0.44) CYP2A6FBP1GRIN2DGRIN3BGRIN1
SCHEMBL7708266 0.78 CYP1A2 (0.39) SMN1; SMN2ACHEGRIN2DGRIN3BGRIN1
SCHEMBL7711600 0.78 ALDH1A1 (0.50) CYP2A6RAB9ANPC1SMN1; SMN2NFE2L2
SCHEMBL7708106 0.78 CYP2A6 (0.50) CYP2A6RAB9ANPC1SMN1; SMN2TDP1
SCHEMBL2264621 0.77 ALDH1A1 (0.40) CYP2A6NFE2L2L3MBTL1ALOX5IDO1

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
CN-1159623-C Radiation-sensitive compsn. of chemical amplification type containing onium salt type photosensitive acid generating agent 克拉瑞特金融(BVI)有限公司 2004-07-28 CN disclosed
US-6358665-B1 ONIUM SALT PRECURSOR FOR GENERATING FLUOROALKYLSULFONATE CLARIANT INTERNATIONAL LTD. (CH) 2002-03-19 US disclosed
CN-1274433-A Radiation-sensitive compsn. of chemical amplification type containing onium salt type photosensitive acid generating agent CLARIANT INT LTD (CH) 2000-11-22 CN disclosed
EP-1033624-A1 RADIATION-SENSITIVE COMPOSITION OF CHEMICAL AMPLIFICATION TYPE Clariant International Ltd. (CH) 2000-09-06 EP disclosed
US-4076537-A Light-sensitive materials containing organo tellurium or selenium compounds and sensitizers FUJI PHOTO FILM CO., LTD. (JA) 1978-02-28 US disclosed
US-4062685-A ORGANO-TELLURIUM COMPOUND FUJI PHOTO FILM CO., LTD. (JA) 1977-12-13 US disclosed