SCHEMBL8777893

SCHEMBL8777893

CC(C)(C)c1cc(C(=O)Nc2ccccc2NC(=O)NC2CCCC2)cc(C(C)(C)C)c1O

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.59
SMN1; SMN2 Q16637 3/20 0.59
MEN1 O00255 2/20 0.59
HTT P42858 1/20 0.59
PKM P14618 1/20 0.53
P2RY1 P47900 1/20 0.53
MAOB P27338 1/20 0.52
RAB9A P51151 3/20 0.50
NPC1 O15118 2/20 0.50
KDM4E B2RXH2 2/20 0.50
ALDH1A1 P00352 2/20 0.50
EPHX1 P07099 3/20 0.48
TP53 P04637 1/20 0.48
EPHX2 P34913 3/20 0.47
LMNA P02545 1/20 0.47
TSHR P16473 1/20 0.46

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
SCHEMBL8777858 0.86 F10 (0.49) KMT2ASMN1; SMN2MEN1RAB9ANPC1
SCHEMBL8806034 0.80 KMT2A (0.59) KMT2ASMN1; SMN2MEN1HTTPKM
SCHEMBL11806800 0.80 MAOB (0.59) KMT2ASMN1; SMN2MEN1MAOBRAB9A
SCHEMBL8803427 0.79 KMT2A (0.53) KMT2ASMN1; SMN2MEN1HTTPKM
SCHEMBL8803421 0.79 KMT2A (0.53) KMT2ASMN1; SMN2MEN1HTTPKM
SCHEMBL8805456 0.79 KMT2A (0.61) KMT2ASMN1; SMN2MEN1HTTPKM
SCHEMBL8804783 0.79 KMT2A (0.61) KMT2ASMN1; SMN2MEN1HTTPKM
SCHEMBL8803651 0.79 KMT2A (0.61) KMT2ASMN1; SMN2MEN1HTTPKM
SCHEMBL8803907 0.79 KMT2A (0.61) KMT2ASMN1; SMN2MEN1HTTPKM
SCHEMBL3661171 0.77 TOP1 (0.57) KMT2AMEN1HTTRAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0665216-B1 Urea derivatives and their use as acat inhibitors NISSHIN FLOUR MILLING CO (JP) 1997-12-29 EP disclosed
US-5576335-A TREATMENT OF HYPERCHOLESTEROLEMIA AND ATHEROSCLEROSIS NISSHIN FLOUR MILLING CO., LTD. (JP) 1996-11-19 US disclosed
EP-0665216-A1 Urea derivatives and their use as acat inhibitors NISSHIN FLOUR MILLING CO., LTD. (JP) 1995-08-02 EP disclosed