SCHEMBL2605529

SCHEMBL2605529

COC(=O)c1ccc(C(=O)Nc2cc(S(=O)(=O)c3ccc(O)c(NC(=O)c4ccc(C(=O)OC)c(C)c4)c3)ccc2O)cc1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.48
MAPT P10636 6/20 0.46
RAB9A P51151 3/20 0.46
KMT2A Q03164 6/20 0.44
KDM4E B2RXH2 3/20 0.44
POLB P06746 2/20 0.44
HPGD P15428 2/20 0.43
KCNMA1 Q12791 2/20 0.43
MEN1 O00255 5/20 0.43
CA12 O43570 3/20 0.43
CA1 P00915 3/20 0.43
CA2 P00918 3/20 0.43
CA9 Q16790 3/20 0.43
BCL2 P10415 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
LMNA P02545 2/20 0.42
NPC1 O15118 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
TP53 P04637 1/20 0.42
TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL2605535 0.88 MEN1 (0.52) ALDH1A1MAPTRAB9AKMT2APOLB
SCHEMBL19492088 0.87 MEN1 (0.45) ALDH1A1MAPTRAB9AKMT2APOLB
SCHEMBL10001979 0.86 KMT2A (0.52) ALDH1A1MAPTRAB9AKMT2APOLB
SCHEMBL19846840 0.82 MEN1 (0.42) ALDH1A1MAPTRAB9AKMT2APOLB
SCHEMBL14679679 0.81 ALDH1A1 (0.47) ALDH1A1MAPTRAB9AKMT2AKDM4E
SCHEMBL19846830 0.81 ALDH1A1 (0.41) ALDH1A1MAPTRAB9AKMT2AKDM4E
SCHEMBL2605534 0.81 KDM4E (0.46) ALDH1A1MAPTRAB9AKMT2AKDM4E
SCHEMBL2605546 0.80 KCNMA1 (0.61) ALDH1A1MAPTRAB9AKMT2APOLB
SCHEMBL2890562 0.80 KDM4E (0.47) ALDH1A1MAPTKDM4EPOLBHPGD
SCHEMBL19846842 0.77 KMT2A (0.60) ALDH1A1MAPTRAB9AKMT2APOLB

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
EP-2520977-B1 POSITIVE-TYPE PHOTOSENSITIVE RESIN COMPOSITION TORAY INDUSTRIES (JP) 2017-11-22 EP disclosed
EP-2555053-B1 POSITIVE-TYPE PHOTOSENSITIVE RESIN COMPOSITION TORAY INDUSTRIES (JP) 2017-10-18 EP disclosed
US-8158324-B2 Positive-type photosensitive resin composition TORAY INDUSTRIES, INC. (JP) 2012-04-17 US disclosed
US-20100099041-A1 POSITIVE-TYPE PHOTOSENSITIVE RESIN COMPOSITION TORAY INDUSTRIES, INC. (JP) 2010-04-22 US disclosed