SCHEMBL7702898

SCHEMBL7702898

O=C1CCCCC1CC1CCCCC1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA1 P00915 5/20 0.46
CA2 P00918 5/20 0.46
CA4 P22748 5/20 0.46
CA6 P23280 4/20 0.46
KMT2A Q03164 2/20 0.45
KDM4E B2RXH2 1/20 0.40
NPC1 O15118 3/20 0.38
RAB9A P51151 3/20 0.38
GAA P10253 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
NOS1 P29475 1/20 0.37
NOS2 P35228 1/20 0.37
PTGS1 P23219 3/20 0.34
PTGS2 P35354 3/20 0.34
OPRK1 P41145 1/20 0.34
HTT P42858 1/20 0.34
LMNA P02545 1/20 0.33

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
SCHEMBL993726 0.96 CA1 (0.42) CA1CA2CA4CA6KMT2A
SCHEMBL5918173 0.88 CA1 (0.40) CA1CA2CA4CA6KMT2A
SCHEMBL5918112 0.86 CA1 (0.48) CA1CA2CA4CA6KMT2A
SCHEMBL10052945 0.79 CA1 (0.44) CA1CA2CA4CA6KMT2A
SCHEMBL14577664 0.78 CA1 (0.42) CA1CA2CA4CA6KMT2A
SCHEMBL8019655 0.78 KDM4E (0.47) CA1CA2CA4CA6KMT2A
SCHEMBL3103357 0.77 CA1 (0.41) CA1CA2CA4CA6KMT2A
SCHEMBL11300049 0.76 KMT2A (0.52) CA1CA2CA4CA6KMT2A
SCHEMBL6588342 0.76 CA1 (0.47) CA1CA2CA4CA6KMT2A
SCHEMBL5873450 0.76 CA1 (0.51) CA1CA2CA4CA6KMT2A

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