SCHEMBL20157243

SCHEMBL20157243

CC(C)(C)OC(=O)N1CC2CCNCC1C2

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.42
CHRM1 P11229 1/20 0.42
CHRM3 P20309 1/20 0.42
HSD11B1 P28845 1/20 0.38
NR1H2 P55055 1/20 0.36
PARP1 P09874 2/20 0.35
CCR2 P41597 1/20 0.35
AR P10275 1/20 0.34
HSD17B10 Q99714 1/20 0.34
PREP P48147 1/20 0.34
CHRNB2 P17787 1/20 0.33
CHRNA4 P43681 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
SCHEMBL16882811 0.86 CHRNB2 (0.46) CHRM2CHRM1CHRM3HSD11B1NR1H2
SCHEMBL1711553 0.86 CHRNB2 (0.46) CHRM2CHRM1CHRM3HSD11B1NR1H2
SCHEMBL928271 0.86 CHRNB2 (0.46) CHRM2CHRM1CHRM3HSD11B1NR1H2
SCHEMBL1711225 0.86 CHRNB2 (0.46) CHRM2CHRM1CHRM3HSD11B1NR1H2
SCHEMBL13964499 0.83 CHRM2 (0.51) CHRM2CHRM1CHRM3HSD11B1NR1H2
SCHEMBL12842007 0.83 CHRM2 (0.51) CHRM2CHRM1CHRM3HSD11B1NR1H2
SCHEMBL12526945 0.83 CHRM2 (0.51) CHRM2CHRM1CHRM3HSD11B1NR1H2
SCHEMBL19583627 0.81 CHRM2 (0.47) CHRM2CHRM1CHRM3HSD11B1NR1H2
SCHEMBL30576874 0.81 CHRM2 (0.43) CHRM2CHRM1CHRM3HSD11B1NR1H2
SCHEMBL27043844 0.81 CHRM2 (0.43) CHRM2CHRM1CHRM3HSD11B1NR1H2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023192989-A2 PHTHALAZINONE COMPOUNDS AS PARP7 INHIBITORS AZKARRA THERAPEUTICS, INC. (US) 2023-10-05 WO disclosed
EP-4223761-A1 QUINAZOLINE COMPOUND AND APPLICATION THEREOF Shanghai Pharmaceuticals Holding Co., Ltd. (CN) 2023-08-09 EP disclosed
WO-2023039240-A9 IRREVERSIBLE INHIBITORS OF KRas BIOMEA FUSION, INC. (US) 2023-06-01 WO disclosed
WO-2023061463-A1 NOVEL PYRIMIDOPYRIDINE COMPOUND, PHARMACEUTICAL COMPOSITION THEREOF, AND USE THEREOF 广东东阳光药业有限公司 2023-04-20 WO disclosed
WO-2021041671-A1 KRAS G12D INHIBITORS Mirati Therapeutics, Inc. (US) 2021-03-04 WO disclosed
EP-2704720-B1 PYRUVATE KINASE R ACTIVATORS FOR USE IN THERAPY AGIOS PHARMACEUTICALS INC (US) 2019-08-07 EP disclosed
WO-2018089433-A1 PHENYL mTORC INHIBITORS AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. (US) 2018-05-17 WO disclosed