SCHEMBL334581

SCHEMBL334581

CCC1NC(=O)CN(Cc2ccccc2)C1=O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 5/20 0.59
HDAC6 Q9UBN7 5/20 0.58
HDAC1 Q13547 4/20 0.58
HDAC8 Q9BY41 4/20 0.58
EPHX2 P34913 1/20 0.48
HDAC4 P56524 1/20 0.44
HDAC7 Q8WUI4 1/20 0.44
HDAC10 Q969S8 1/20 0.44
HDAC11 Q96DB2 1/20 0.44
HDAC9 Q9UKV0 1/20 0.44
HDAC5 Q9UQL6 1/20 0.44
DDB1 Q16531 1/20 0.44
CRBN Q96SW2 1/20 0.44
TACR1 P25103 1/20 0.43
GAA P10253 3/20 0.41
PKM P14618 2/20 0.41
POLB P06746 1/20 0.40
GHSR Q92847 1/20 0.40
HTT P42858 1/20 0.40
PAX8 Q06710 1/20 0.40

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
SCHEMBL1714279 1.00 OPRK1 (0.59) OPRK1HDAC6HDAC1HDAC8EPHX2
SCHEMBL6343378 1.00 OPRK1 (0.59) OPRK1HDAC6HDAC1HDAC8EPHX2
SCHEMBL19095468 0.89 OPRK1 (0.57) OPRK1HDAC6HDAC1HDAC8EPHX2
SCHEMBL10219026 0.89 OPRK1 (0.57) OPRK1HDAC6HDAC1HDAC8EPHX2
SCHEMBL1714131 0.89 OPRK1 (0.57) OPRK1HDAC6HDAC1HDAC8EPHX2
SCHEMBL876552 0.87 HDAC6 (0.73) OPRK1HDAC6HDAC1HDAC8EPHX2
SCHEMBL8452072 0.87 HDAC6 (0.73) OPRK1HDAC6HDAC1HDAC8EPHX2
SCHEMBL877776 0.87 HDAC6 (0.73) OPRK1HDAC6HDAC1HDAC8EPHX2
SCHEMBL10219033 0.86 OPRK1 (0.55) OPRK1HDAC6HDAC1HDAC8EPHX2
SCHEMBL8154689 0.86 OPRK1 (0.55) OPRK1HDAC6HDAC1HDAC8EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023125681-A1 HETEROCYCLIC COMPOUNDS BEIGENE, LTD. (KY) 2023-07-06 WO disclosed
CN-106590304-A Cement polymer environmental-friendly exterior wall coating material 佛山市顺德区数码彩涂料有限公司 2017-04-26 CN disclosed
CN-106590304-A Cement polymer environmental-friendly exterior wall coating material 佛山市顺德区数码彩涂料有限公司 2017-04-26 CN disclosed
US-8097610-B2 Derivative having PPAR agonistic activity SHIONOGI & CO., LTD. (JP) 2012-01-17 US disclosed
US-8097610-B2 Derivative having PPAR agonistic activity SHIONOGI & CO., LTD. (JP) 2012-01-17 US disclosed
US-8097610-B2 Derivative having PPAR agonistic activity SHIONOGI & CO., LTD. (JP) 2012-01-17 US disclosed
US-20090286974-A1 Derivative having ppar agonistic activity SHIONOGI & CO., LTD. (JP) 2009-11-19 US disclosed
US-20090286974-A1 Derivative having ppar agonistic activity SHIONOGI & CO., LTD. (JP) 2009-11-19 US disclosed
US-20090286974-A1 Derivative having ppar agonistic activity SHIONOGI & CO., LTD. (JP) 2009-11-19 US disclosed
EP-1939189-A1 DERIVATIVE HAVING PPAR AGONISTIC ACTIVITY SHIONOGI & CO., LTD. (JP) 2008-07-02 EP disclosed
EP-1939189-A1 DERIVATIVE HAVING PPAR AGONISTIC ACTIVITY SHIONOGI & CO., LTD. (JP) 2008-07-02 EP disclosed
US-20050272745-A1 Novel piperidine and piperazine derivatives ASTRAZENECA AB 2005-12-08 US disclosed
US-6969713-B2 Piperidine and piperazine acetamide derivatives ASTRAZENECA AB (SE) 2005-11-29 US disclosed
US-6967201-B1 for increasing activation of the 5-HT2C receptor in mammals; treatment of depression, obesity, bulimia, premenstrual syndrome, alcoholism, tobacco abuse, panic disorder ELI LILLY AND COMPANY (US) 2005-11-22 US disclosed
US-6638936-B1 Treatment of obesity in mammals, comprising administering to mammal in need of such treatment, treatment of obsessive compulsive disorder in mammals, comprising administering to a mammal treatment of depression in mammals ELI LILLY AND COMPANY 2003-10-28 US disclosed
EP-1242427-B1 NOVEL PIPERIDINE AND PIPERAZINE DERIVATIVES AS P2X7 RECEPTOR ANTAGONISTS ASTRAZENECA AB (SE) 2003-08-13 EP disclosed
EP-1204654-B1 BENZOFURYLPIPERAZINES: 5-HT2C SEROTONIN RECEPTOR AGONISTS LILLY CO ELI (US) 2003-07-23 EP disclosed
EP-1204658-B1 BENZOFURYLPIPERAZINE SEROTONIN AGONISTS LILLY CO ELI (US) 2003-05-07 EP disclosed
US-20030013721-A1 Novel piperidine and piperazine derivatives ASTRAZENECA AB (SE) 2003-01-16 US 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-20050272745-A1 Novel piperidine and piperazine derivatives CYP3A5, IL5, ABCC5 OPRK1 366/4885HDAC6 87/4885HDAC1 613/4885
US-20030013721-A1 Novel piperidine and piperazine derivatives IL5, VIP, EP300 OPRK1 148/4885HDAC6 36/4885HDAC1 300/4885
US-20090286974-A1 Derivative having ppar agonistic activity PPARD, PPARA, PPARG OPRK1 301/4885HDAC6 724/4885HDAC1 288/4885

“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.