SCHEMBL7702901

SCHEMBL7702901

[CH2]CC[CH]c1ccc(O)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH5A1 P51649 1/20 0.48
ABAT P80404 1/20 0.48
ALDH1A1 P00352 6/20 0.41
MAPT P10636 5/20 0.41
APP P05067 4/20 0.41
MAOB P27338 3/20 0.39
AKR1B1 P15121 2/20 0.39
PTGS2 P35354 2/20 0.39
AKR1B10 O60218 1/20 0.39
GLO1 Q04760 1/20 0.39
CAMK2A Q9UQM7 1/20 0.39
KDM4E B2RXH2 4/20 0.38
KMT2A Q03164 4/20 0.38
MEN1 O00255 3/20 0.38
CA12 O43570 3/20 0.38
CA1 P00915 3/20 0.38
CA2 P00918 3/20 0.38
LMNA P02545 3/20 0.38
CA3 P07451 3/20 0.38
CYP3A4 P08684 3/20 0.38

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
SCHEMBL11050322 0.87 ALDH1A1 (0.35) ALDH1A1
SCHEMBL7702823 0.86 ALDH5A1 (0.44) ALDH5A1ABATALDH1A1MAPTAPP
SCHEMBL7801924 0.80 ALDH5A1 (0.52) ALDH5A1ABATALDH1A1MAPTAPP
SCHEMBL7708200 0.76 HSD17B10 (0.48) MAOBLMNAHSD17B10CYP1A2TRPA1
SCHEMBL5641505 0.76 ALDH1A1 (0.50) ALDH5A1ABATALDH1A1MAPTAPP
SCHEMBL5469370 0.76 CYP2A6 (0.48) ALDH1A1MAPTPTGS2KDM4EKMT2A
SCHEMBL245276 0.75 ALDH1A1 (0.43) ALDH1A1MAPTMAOBKMT2AMEN1
SCHEMBL7355796 0.74 ESR1 (0.56) ALDH5A1ABATALDH1A1PTGS2KDM4E
SCHEMBL363138 0.73 ALDH5A1 (0.50) ALDH5A1ABATALDH1A1MAPTAPP
SCHEMBL6422361 0.73 ALDH1A1 (0.47) ALDH5A1ABATALDH1A1MAPTPTGS2

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
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