SCHEMBL1821657

SCHEMBL1821657

c1ccc2c(c1)NCC21CCOCC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TNKS O95271 1/20 0.40
▸ TNKS2 Q9H2K2 1/20 0.40
▸ OPRM1 P35372 1/20 0.39
▸ OPRL1 P41146 1/20 0.39
▸ HTR2C P28335 1/20 0.38
▸ KDM1A O60341 1/20 0.38
▸ AVPR1A P37288 1/20 0.38
▸ KCNH2 Q12809 1/20 0.35
▸ HDAC1 Q13547 1/20 0.35
▸ MEN1 O00255 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ BACE1 P56817 2/20 0.33
▸ PDE7A Q13946 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ CCR5 P51681 1/20 0.31
▸ PRNP P04156 1/20 0.30
▸ LRRK2 Q5S007 1/20 0.30

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
Hydrochloric Acid SCHEMBL25280639 0.98 TNKS (0.39) TNKSTNKS2OPRM1OPRL1HTR2C
SCHEMBL13209521 0.89 KDM1A (0.39) TNKSTNKS2OPRM1OPRL1HTR2C
SCHEMBL29479467 0.86 TNKS (0.44) TNKSTNKS2OPRM1OPRL1HTR2C
SCHEMBL1012828 0.86 TNKS (0.44) TNKSTNKS2OPRM1OPRL1HTR2C
SCHEMBL13209513 0.84 KDM1A (0.47) TNKSTNKS2OPRM1OPRL1HTR2C
SCHEMBL1828877 0.82 TNKS (0.45) TNKSTNKS2OPRM1OPRL1KDM1A
SCHEMBL29609239 0.82 TNKS (0.45) TNKSTNKS2OPRM1OPRL1HTR2C
SCHEMBL2260175 0.82 TNKS (0.45) TNKSTNKS2OPRM1OPRL1HTR2C
SCHEMBL29384445 0.82 TNKS (0.45) TNKSTNKS2OPRM1OPRL1KDM1A
Hydrochloric Acid SCHEMBL16600202 0.81 TNKS (0.44) TNKSTNKS2OPRM1OPRL1HTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9090593-B2 Bicyclic compounds as Pim inhibitors AMGEN INC. (US) 2015-07-28 — — US claimed
US-20140031360-A1 BICYCLIC COMPOUNDS AS PIM INHIBITORS AMGEN INC. (US) 2014-01-30 — — US claimed
EP-2649065-A1 BICYCLIC COMPOUNDS AS PIM INHIBITORS Amgen Inc. (US) 2013-10-16 — — EP claimed
WO-2012078777-A1 BICYCLIC COMPOUNDS AS PIM INHIBITORS AMGEN INC. (US) 2012-06-14 — — WO claimed
CN-116546990-B CD73 inhibitor and pharmaceutical application thereof RISEN (SUZHOU) PHARMA TECH Co.,Ltd. (CN) 2026-05-26 — — CN disclosed
CN-119060016-A Amide derivative with RSV (respiratory syncytial virus) inhibition activity as well as preparation method and application thereof 杭州师范大学 2024-12-03 — — CN disclosed
CN-114539340-B CD73 inhibitor and pharmaceutical application thereof 润佳(苏州)医药科技有限公司 2024-06-07 — — CN disclosed
US-20240024346-A1 CD73 INHIBITORS AND PHARMACEUTICAL USES THEREOF RISEN SUZHOU PHARMA TECH CO LTD (CN) 2024-01-25 — — US disclosed
US-20240024346-A1 CD73 INHIBITORS AND PHARMACEUTICAL USES THEREOF RISEN SUZHOU PHARMA TECH CO LTD (CN) 2024-01-25 — — US disclosed
CN-116546990-A CD73 inhibitor and pharmaceutical application thereof 润佳(苏州)医药科技有限公司 2023-08-04 — — CN disclosed
CN-108495855-B Fused thiazolopyrimidine derivatives as MNK inhibitors 生命弧度公司 2022-05-31 — — CN disclosed
CN-114539340-A CD73 inhibitor and pharmaceutical application thereof 润佳(苏州)医药科技有限公司 2022-05-27 — — CN disclosed
US-20080287504-A1 CB1 MODULATOR COMPOUNDS ALLEN JENNIFER REBECCA 2008-11-20 — — US disclosed
US-20080287504-A1 CB1 MODULATOR COMPOUNDS ALLEN JENNIFER REBECCA 2008-11-20 — — US disclosed
US-7276516-B2 CB1 antagonist compounds ELI LILLY AND COMPANY (US) 2007-10-02 — — US disclosed
US-7276516-B2 CB1 antagonist compounds ELI LILLY AND COMPANY (US) 2007-10-02 — — US disclosed
US-7276516-B2 CB1 antagonist compounds ELI LILLY AND COMPANY (US) 2007-10-02 — — US disclosed
US-20070088018-A1 Cb1 antagonist compounds ELI LILLY AND COMPANY (US) 2007-04-19 — — US disclosed
US-20070088018-A1 Cb1 antagonist compounds ELI LILLY AND COMPANY (US) 2007-04-19 — — US disclosed
US-20070088018-A1 Cb1 antagonist compounds ELI LILLY AND COMPANY (US) 2007-04-19 — — 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 (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-20070088018-A1 Cb1 antagonist compounds CNR1, CNR2, CHRNA5 TNKS 2329/4885TNKS2 3520/4885OPRM1 32/4885
US-20240024346-A1 CD73 INHIBITORS AND PHARMACEUTICAL USES THEREOF ENTPD5, NT5E, ENTPD1 TNKS 222/4885TNKS2 354/4885OPRM1 3364/4885
US-20140031360-A1 BICYCLIC COMPOUNDS AS PIM INHIBITORS PIM1, PIM2, PIM3 TNKS 453/4885TNKS2 717/4885OPRM1 3642/4885
US-20080287504-A1 CB1 MODULATOR COMPOUNDS CNR1, CNR2, MAG TNKS 2431/4885TNKS2 3754/4885OPRM1 27/4885

“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.

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