SCHEMBL2184245

SCHEMBL2184245

NC(=O)C1(c2ccccc2)CCC1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AKR1C1 Q04828 1/20 0.64
HDAC4 P56524 3/20 0.56
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
HSD11B1 P28845 3/20 0.50
OPRL1 P41146 1/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
HTT P42858 2/20 0.49
LMNA P02545 3/20 0.47
NPSR1 Q6W5P4 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
GAA P10253 1/20 0.45
ALDH1A1 P00352 1/20 0.45
FTO Q9C0B1 1/20 0.44
P2RX7 Q99572 1/20 0.44

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
SCHEMBL42114 0.96 AKR1C1 (0.70) AKR1C1HDAC4MEN1KMT2AHSD11B1
SCHEMBL43810 0.94 AKR1C1 (0.68) AKR1C1HDAC4MEN1KMT2AHSD11B1
SCHEMBL501923 0.91 AKR1C1 (0.57) AKR1C1HDAC4MEN1KMT2AHSD11B1
SCHEMBL2722547 0.91 AKR1C1 (0.57) AKR1C1HDAC4MEN1KMT2AHSD11B1
Hydrochloric Acid SCHEMBL1804765 0.89 AKR1C1 (0.55) AKR1C1HDAC4MEN1KMT2AHSD11B1
SCHEMBL4560518 0.84 AKR1C1 (0.47) AKR1C1HDAC4MEN1KMT2ASMN1; SMN2
SCHEMBL3113268 0.83 AKR1C1 (0.69) AKR1C1HDAC4MEN1KMT2AHSD11B1
SCHEMBL1667343 0.83 AKR1C1 (0.91) AKR1C1HDAC4MEN1KMT2AHSD11B1
SCHEMBL2703559 0.82 ALDH1A1 (0.58) AKR1C1OPRL1SMN1; SMN2LMNANPSR1
SCHEMBL8366154 0.82 OPRL1 (0.56) AKR1C1HDAC4MEN1KMT2AHSD11B1

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 61 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116375549-A Method and system for synthesizing amide compound from nitrile compound 深圳湾实验室 2023-07-04 CN claimed
CN-109563085-B Piperidine CXCR7 receptor modulators 爱杜西亚药品有限公司 2022-08-09 CN claimed
EP-3490986-B1 PIPERIDINE CXCR7 RECEPTOR MODULATORS IDORSIA PHARMACEUTICALS LTD (CH) 2021-11-24 EP claimed
US-10752620-B2 Piperdine CXCR7 receptor modulators IDORSIA PHARMACEUTICALS LTD. (CH) 2020-08-25 US claimed
US-20190169180-A1 PIPERDINE CXCR7 RECEPTOR MODULATORS ACTELION PHARMACEUTICALS LTD. (CH) 2019-06-06 US claimed
EP-3490986-A1 PIPERIDINE CXCR7 RECEPTOR MODULATORS Idorsia Pharmaceuticals Ltd (CH) 2019-06-05 EP claimed
CN-109563085-A piperidine CXCR7 receptor modulators 爱杜西亚药品有限公司 2019-04-02 CN claimed
WO-2018019929-A1 PIPERIDINE CXCR7 RECEPTOR MODULATORS IDORSIA PHARMACEUTICALS LTD (CH) 2018-02-01 WO claimed
EP-3057964-A1 SELECTIVELY SUBSTITUTED QUINOLINE COMPOUNDS Eisai R&D Management Co., Ltd. (JP) 2016-08-24 EP claimed
EP-2261203-B1 PHENYLCYCLOBUTYLAMIDE DERIVATIVES AND THEIR STEREOISOMERS, THE PREPARING PROCESSES AND THE USES THEREOF BEIJING YINGU CENTURY PHARMACY CO LTD (CN) 2016-05-25 EP claimed
CN-104854083-A Aminocyclobutane derivatives, process for their preparation and their use as medicaments PF MEDICAMENT 2015-08-19 CN claimed
WO-2015057659-A1 SELECTIVELY SUBSTITUTED QUINOLINE COMPOUNDS EISAI R&D MANAGEMENT CO., LTD. (JP) 2015-04-23 WO claimed
US-8673981-B2 Phenylcyclobutylamide derivatives and their stereoisomers, the preparation processes and uses thereof YinGu Pharmaceutical Co., Ltd (CN) 2014-03-18 US claimed
US-20130289124-A1 PHENYLCYCLOBUTYLAMIDE DERIVATIVES AND THEIR STEREOISOMERS, THE PREPARATION PROCESSES AND USES THEREOF YinGu Pharmaceutical Co., Ltd (CN) 2013-10-31 US claimed
US-8497305-B2 Phenylcyclobutylamide derivatives and their stereoisomers, the preparation processes and uses thereof YinGu Pharmaceutical Co., Ltd (CN) 2013-07-30 US claimed
US-20110224305-A1 PHENYLCYCLOBUTYLAMIDE DERIVATIVES AND THEIR STEREOISOMERS, THE PREPARATION PROCESSES AND USES THEREOF BEIJING YINGU CENTURY PHARMACY CO. LTD (CN) 2011-09-15 US claimed
EP-2261203-A1 PHENYLCYCLOBUTYLAMIDE DERIVATIVES AND THEIR STEREOISOMERS, THE PREPARING PROCESSES AND THE USES THEREOF Beijing Cachet Biomedical Co., Ltd (CN) 2010-12-15 EP claimed
CN-116528857-A MALT-1 modulators 艾克斯赛安西娅人工智能有限公司 2023-08-01 CN disclosed
EP-1490043-A2 SPIROCYCLIC AMIDES AS CANNABINOID RECEPTOR MODULATORS Merck & Co., Inc. (US) 2004-12-29 EP disclosed
WO-2003082190-A2 SPIROCYCLIC AMIDES AS CANNABINOID RECEPTOR MODULATORS MERCK & CO., INC. (US) 2003-10-09 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 (4 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-20110224305-A1 PHENYLCYCLOBUTYLAMIDE DERIVATIVES AND THEIR STEREOISOMERS, THE PREPARATION PROCESSES AND USES THEREOF AADAC, WIZ, CEBPZ AKR1C1 3650/4885HDAC4 292/4885MEN1 4756/4885
US-20190169180-A1 PIPERDINE CXCR7 RECEPTOR MODULATORS CXCR1, CXCR5, ACKR3 AKR1C1 1299/4885HDAC4 2022/4885MEN1 4254/4885
US-20130289124-A1 PHENYLCYCLOBUTYLAMIDE DERIVATIVES AND THEIR STEREOISOMERS, THE PREPARATION PROCESSES AND USES THEREOF AADAC, WIZ, CEBPZ AKR1C1 3650/4885HDAC4 292/4885MEN1 4756/4885
US-10752620-B2 Piperdine CXCR7 receptor modulators CXCR1, CXCR5, ACKR3 AKR1C1 1299/4885HDAC4 2022/4885MEN1 4254/4885

“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.