SCHEMBL19664048

SCHEMBL19664048

CC(C)(C)OC(=O)C(N)Cc1cccc(F)c1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 3/20 0.55
SLC1A1 P43005 2/20 0.51
CTSS P25774 1/20 0.51
CTSK P43235 1/20 0.51
ROCK2 O75116 1/20 0.45
DPP4 P27487 3/20 0.44
DPP7 Q9UHL4 2/20 0.44
DPP8 Q6V1X1 1/20 0.44
DPP9 Q86TI2 1/20 0.44
MAOB P27338 2/20 0.43
PPARG P37231 2/20 0.43
PPARA Q07869 1/20 0.42
RIPK1 Q13546 1/20 0.42
KDM4E B2RXH2 1/20 0.41
GAA P10253 1/20 0.41
STAT1 P42224 1/20 0.41
RAB9A P51151 1/20 0.41
GPR119 Q8TDV5 1/20 0.41
ROCK1 Q13464 1/20 0.41

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
SCHEMBL30475895 1.00 SLC7A5 (0.55) SLC7A5SLC1A1CTSSCTSKROCK2
SCHEMBL10561439 1.00 SLC7A5 (0.55) SLC7A5SLC1A1CTSSCTSKROCK2
SCHEMBL18788872 0.84 SLC7A5 (0.56) SLC7A5
SCHEMBL27525604 0.84 SLC7A5 (0.56) SLC7A5
SCHEMBL18481474 0.84 SLC7A5 (0.56) SLC7A5MAOB
SCHEMBL3028647 0.84 SLC7A5 (0.56) SLC7A5
SCHEMBL75362 0.84 SLC1A1 (0.55) SLC7A5SLC1A1ROCK2DPP4DPP7
SCHEMBL6162540 0.84 SLC1A1 (0.55) SLC7A5SLC1A1ROCK2DPP4DPP7
SCHEMBL5739966 0.84 SLC1A1 (0.55) SLC7A5SLC1A1ROCK2DPP4DPP7
SCHEMBL10557764 0.84 HTR2A (0.58) SLC7A5DPP4DPP7DPP8DPP9

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
US-20230373972-A1 PIPERAZINE DERIVATIVE, PREPARATION METHOD THEREFOR AND USE THEREOF ZHEJIANG HISUN PHARMACEUTICAL CO., LTD. (CN) 2023-11-23 US disclosed
US-20230373972-A1 PIPERAZINE DERIVATIVE, PREPARATION METHOD THEREFOR AND USE THEREOF ZHEJIANG HISUN PHARMACEUTICAL CO., LTD. (CN) 2023-11-23 US disclosed
US-20230373972-A1 PIPERAZINE DERIVATIVE, PREPARATION METHOD THEREFOR AND USE THEREOF ZHEJIANG HISUN PHARMACEUTICAL CO., LTD. (CN) 2023-11-23 US disclosed
EP-4215525-A1 PIPERAZINE DERIVATIVE, PREPARATION METHOD THEREFOR AND USE THEREOF Zhejiang Hisun Pharmaceutical Co., Ltd. (CN) 2023-07-26 EP disclosed
CN-116348109-A Piperazine derivative, and preparation method and application thereof 浙江海正药业股份有限公司 2023-06-27 CN disclosed
US-20180177890-A1 LIGAND-CYTOTOXIC DRUG CONJUGATE, PREPARATION METHOD THEREOF, AND USE THEREOF JIANGSU HENGRUI MEDICINE CO., LTD. (CN) 2018-06-28 US disclosed
EP-3251698-A1 LIGAND-CYTOTOXICITY DRUG CONJUGATE, PREPARING METHOD THEREFOR, AND APPLICATION THEREOF Jiangsu Hengrui Medicine Co. Ltd. (CN) 2017-12-06 EP 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 (2 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-20180177890-A1 LIGAND-CYTOTOXIC DRUG CONJUGATE, PREPARATION METHOD THEREOF, AND USE THEREOF LDLR, SELPLG, FOLR1 SLC7A5 1738/4885SLC1A1 2938/4885CTSS 1724/4885
US-20230373972-A1 PIPERAZINE DERIVATIVE, PREPARATION METHOD THEREFOR AND USE THEREOF F7, F11, HABP2 SLC7A5 2070/4885SLC1A1 2367/4885CTSS 644/4885

“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.