SCHEMBL22720703

SCHEMBL22720703

CC(C)(C)OC(=O)N1CC2(CCN(c3ncc(Br)cn3)CC2)C1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 1/20 0.49
GPR119 Q8TDV5 8/20 0.47
ACACB O00763 3/20 0.46
MAPT P10636 1/20 0.45
HSD17B10 Q99714 3/20 0.45
TSHR P16473 1/20 0.45
CYP3A4 P08684 1/20 0.44
SCD5 Q86SK9 1/20 0.43
CYP2D6 P10635 2/20 0.42
RET P07949 1/20 0.42

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
SCHEMBL22721094 0.90 ALDH1A1 (0.48) CYP11B2GPR119ACACBMAPTHSD17B10
SCHEMBL16430907 0.89 CYP11B2 (0.51) CYP11B2GPR119ACACBMAPTHSD17B10
SCHEMBL25447173 0.89 GPR119 (0.54) CYP11B2GPR119ACACBMAPTRET
SCHEMBL26100649 0.85 RET (0.51) CYP11B2GPR119ACACBSCD5RET
SCHEMBL30392218 0.85 RET (0.51) CYP11B2GPR119ACACBSCD5RET
SCHEMBL712231 0.84 GPR119 (0.60) GPR119MAPTTSHR
SCHEMBL22720835 0.82 GPR119 (0.50) CYP11B2GPR119ACACBMAPTHSD17B10
SCHEMBL30112430 0.82 CYP11B2 (0.45) CYP11B2GPR119ACACBSCD5RET
SCHEMBL24880671 0.82 CYP11B2 (0.45) CYP11B2GPR119ACACBSCD5RET
SCHEMBL32679621 0.82 ACACB (0.46) CYP11B2GPR119ACACBMAPTHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116322700-B Novel PLK1 degradation inducing compounds 厄普特拉株式会社 2024-08-20 CN disclosed
US-11912710-B2 Substituted pyrimido[4,5-b][1,4]diazepines as PLK1 degradation inducers UPPTHERA, INC. (KR) 2024-02-27 US disclosed
US-11912710-B2 Substituted pyrimido[4,5-b][1,4]diazepines as PLK1 degradation inducers UPPTHERA, INC. (KR) 2024-02-27 US disclosed
US-11912710-B2 Substituted pyrimido[4,5-b][1,4]diazepines as PLK1 degradation inducers UPPTHERA, INC. (KR) 2024-02-27 US disclosed
US-20230219966-A1 NOVEL PLK1 DEGRADATION INDUCING COMPOUND UPPTHERA, INC. (KR) 2023-07-13 US disclosed
US-20230219966-A1 NOVEL PLK1 DEGRADATION INDUCING COMPOUND UPPTHERA, INC. (KR) 2023-07-13 US disclosed
US-20230219966-A1 NOVEL PLK1 DEGRADATION INDUCING COMPOUND UPPTHERA, INC. (KR) 2023-07-13 US disclosed
EP-4157849-A1 NOVEL PLK1 DEGRADATION INDUCING COMPOUND Uppthera, Inc. (KR) 2023-04-05 EP disclosed
WO-2023018238-A1 NOVEL PLK1 DEGRADATION INDUCING COMPOUND UPPTHERA, INC. (KR) 2023-02-16 WO disclosed
WO-2023018238-A1 NOVEL PLK1 DEGRADATION INDUCING COMPOUND UPPTHERA, INC. (KR) 2023-02-16 WO disclosed
WO-2023017446-A1 NOVEL PLK1 DEGRADATION INDUCING COMPOUND UPPTHERA, INC. (KR) 2023-02-16 WO disclosed
WO-2023017446-A1 NOVEL PLK1 DEGRADATION INDUCING COMPOUND UPPTHERA, INC. (KR) 2023-02-16 WO disclosed
US-11542266-B1 Substituted piperidines as BTK inhibitors HAISCO PHARMACEUTICALS PTE. LTD. (SG) 2023-01-03 US disclosed
EP-3978496-A1 BTK INHIBITOR RING DERIVATIVE, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL APPLICATION THEREOF Haisco Pharmaceuticals Pte. Ltd. (SG) 2022-04-06 EP disclosed
WO-2020239103-A1 BTK INHIBITOR RING DERIVATIVE, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL APPLICATION THEREOF 四川海思科制药有限公司 2020-12-03 WO disclosed
WO-2020239103-A1 BTK INHIBITOR RING DERIVATIVE, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL APPLICATION THEREOF 四川海思科制药有限公司 2020-12-03 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230219966-A1 NOVEL PLK1 DEGRADATION INDUCING COMPOUND PLK1, BUB1B, BUB1 CYP11B2 3804/4885GPR119 4495/4885ACACB 1522/4885
US-11542266-B1 Substituted piperidines as BTK inhibitors BTK, BLK, SYK CYP11B2 4186/4885GPR119 2437/4885ACACB 3488/4885
US-11912710-B2 Substituted pyrimido[4,5-b][1,4]diazepines as PLK1 degradation inducers PLK1, BUB1B, BUB1 CYP11B2 2597/4885GPR119 4626/4885ACACB 2427/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.