SCHEMBL14679679

SCHEMBL14679679

COC(=O)Cc1ccc(C(=O)Nc2cc(S(=O)(=O)c3ccc(O)c(NC(=O)c4ccc(CC(=O)OC)c(C)c4)c3)ccc2O)cc1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.47
RAB9A P51151 5/20 0.45
NPC1 O15118 4/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
MAPT P10636 3/20 0.43
CA12 O43570 4/20 0.40
CA1 P00915 4/20 0.40
CA2 P00918 4/20 0.40
CA9 Q16790 4/20 0.40
KCNMA1 Q12791 2/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
LMNA P02545 2/20 0.39
POLB P06746 1/20 0.39
CFD P00746 1/20 0.39
NR1H4 Q96RI1 1/20 0.38
KDM4E B2RXH2 1/20 0.38
GLA P06280 1/20 0.38
HPGD P15428 1/20 0.38
GAA P10253 1/20 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
SCHEMBL14679673 0.82 NR1H4 (0.48) ALDH1A1RAB9ANPC1SMN1; SMN2MAPT
SCHEMBL10001979 0.82 KMT2A (0.52) ALDH1A1RAB9ANPC1SMN1; SMN2MAPT
SCHEMBL2605529 0.81 ALDH1A1 (0.48) ALDH1A1RAB9ANPC1SMN1; SMN2MAPT
SCHEMBL12937554 0.80 ALDH1A1 (0.42) ALDH1A1RAB9ANPC1SMN1; SMN2MAPT
SCHEMBL2605535 0.79 MEN1 (0.52) ALDH1A1RAB9ANPC1SMN1; SMN2MAPT
SCHEMBL19846830 0.77 ALDH1A1 (0.41) ALDH1A1RAB9ANPC1SMN1; SMN2MAPT
SCHEMBL2605546 0.77 KCNMA1 (0.61) ALDH1A1RAB9ANPC1SMN1; SMN2MAPT
SCHEMBL19492088 0.74 MEN1 (0.45) ALDH1A1RAB9AMAPTCA12CA1
SCHEMBL19846842 0.73 KMT2A (0.60) ALDH1A1RAB9ANPC1SMN1; SMN2MAPT
SCHEMBL14228242 0.73 MAPT (0.58) ALDH1A1RAB9AMAPTCA12CA1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2555053-A1 Positive-type photosensitive resin composition Toray Industries, Inc. (JP) 2013-02-06 EP disclosed