SCHEMBL18329993

SCHEMBL18329993

CC(C)(C)OC(=O)NNN

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
APLNR P35414 1/20 0.44
GAA P10253 4/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
MAPK1 P28482 1/20 0.41
TDP1 Q9NUW8 1/20 0.39
DGAT1 O75907 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
CA1 P00915 2/20 0.38
CA7 P43166 2/20 0.38
CA2 P00918 1/20 0.38
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
MIF P14174 1/20 0.37
LMNA P02545 1/20 0.37
POLB P06746 1/20 0.37
CA12 O43570 1/20 0.36
CA14 Q9ULX7 1/20 0.36

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
SCHEMBL284141 0.84 APLNR (0.55) APLNRGAAMEN1KMT2AMAPK1
SCHEMBL19273270 0.80 APLNR (0.48) APLNRGAAMEN1KMT2AMAPK1
SCHEMBL6245779 0.79 MEN1 (0.49) APLNRGAAMEN1KMT2AMAPK1
SCHEMBL6237 0.79
SCHEMBL8520807 0.79 APLNR (0.47) APLNRGAAMEN1KMT2AMAPK1
SCHEMBL4150198 0.79 APLNR (0.47) APLNRGAAMEN1KMT2AMAPK1
SCHEMBL11525177 0.79 MEN1 (0.56) APLNRGAAMEN1KMT2AMAPK1
SCHEMBL24514107 0.77 APLNR (0.50) APLNRGAAMEN1KMT2AMAPK1
Methane SCHEMBL6175773 0.77 DGAT1 (0.41) APLNRGAAMEN1KMT2ATDP1
Methylamine SCHEMBL2149434 0.77 DGAT1 (0.41) APLNRGAAMEN1KMT2ATDP1

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
WO-2026098560-A2 BENZENE-CONTAINING POLYCYCLIC DERIVATIVE MODULATOR, PREPARATION METHOD THEREFOR AND USE THEREOF 上海翰森生物医药科技有限公司 2026-05-15 WO disclosed
CN-118255705-A Preparation method of (1H-pyrrole-1-yl) carbamic acid tert-butyl ester 南京药石科技股份有限公司 2024-06-28 CN disclosed
WO-2016202755-A1 3-AMINO-1,5,6,7-TETRAHYDRO-4H-INDOL-4-ONES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-12-22 WO disclosed