SCHEMBL3221495

SCHEMBL3221495

CN(C)c1ccc2cc(N)ccc2n1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.58
▸ LMNA P02545 2/20 0.58
▸ POLB P06746 1/20 0.58
▸ CASP6 P55212 1/20 0.58
▸ PLAU P00749 1/20 0.57
▸ NCF1 P14598 1/20 0.55
▸ HTT P42858 2/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ F2 P00734 1/20 0.47
▸ CHRM2 P08172 1/20 0.47
▸ HTR1A P08908 1/20 0.47
▸ ADRA2A P08913 1/20 0.47
▸ ADORA3 P0DMS8 1/20 0.47
▸ MAOA P21397 1/20 0.47
▸ DRD1 P21728 1/20 0.47
▸ ACHE P22303 1/20 0.47
▸ PTGS1 P23219 1/20 0.47
▸ SLC6A2 P23975 1/20 0.47
▸ SLC6A4 P31645 1/20 0.47

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
SCHEMBL22926877 0.79 LMNA (0.47) KDM4ELMNAPOLBCASP6PLAU
SCHEMBL31143623 0.78 CYP1A2 (0.59) KDM4EPOLBNCF1MEN1KMT2A
SCHEMBL8275784 0.78 CYP1A2 (0.59) KDM4EPOLBNCF1MEN1KMT2A
SCHEMBL1500224 0.77 NCF1 (0.55) KDM4ENCF1HTTMEN1KMT2A
SCHEMBL21864963 0.77 NCF1 (0.55) NCF1HTTALDH1A1TSHRTTR
SCHEMBL14288335 0.76 NCF1 (0.53) NCF1ADRA2ASMN1; SMN2NPC1RAB9A
SCHEMBL22926818 0.75 KDM4E (0.44) KDM4ELMNAPOLBCASP6PLAU
SCHEMBL9420844 0.74 NCF1 (0.59) KDM4ELMNAPOLBNCF1MEN1
SCHEMBL30301243 0.74 NCF1 (0.59) KDM4ELMNAPOLBNCF1MEN1
SCHEMBL116001 0.74 LMNA (1.00) KDM4ELMNAPOLBCASP6PLAU

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12286429-B2 5-oxo-1,2,3,5,8,8a-hexahydroindolizine-3-carboxamide derivatives useful as a factor XIa inhibitors JANSSEN PHARMACEUTICA NV (BE) 2025-04-29 — — US disclosed
US-20230064443-A1 5-oxo-1,2,3,5,8,8a-hexahydroindolizine-3-carboxamide Derivatives Useful As a Factor XIa Inhibitors JANSSEN PHARMACEUTICA NV (BE) 2023-03-02 — — US disclosed
EP-2956138-B1 THERAPEUTIC COMPOUNDS AND USES THEREOF KALA PHARMACEUTICALS INC (US) 2022-06-22 — — EP disclosed
US-20180133225-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF KALA BIO, Inc. 2018-05-17 — — US disclosed
US-9353122-B2 Therapeutic compounds and uses thereof KALA PHARMACEUTICALS, INC. (US) 2016-05-31 — — US disclosed
US-20140235634-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF KALA PHARMACEUTICALS, INC. (US) 2014-08-21 — — US disclosed
US-7683097-B2 Topoisomerase inhibitors Propharmacon Inc. (US) 2010-03-23 — — US disclosed
US-20070004701-A1 Topoisomerase inhibitors PROPHARMACON, INC. (US) 2007-01-04 — — US disclosed
WO-2006022955-A2 TOPOISOMERASE INHIBITORS PROPHARMACON, INC. (US) 2006-03-02 — — WO disclosed
EP-1373252-A1 CHEMICAL DERIVATIVES AND THEIR USE AS ANTI-TELOMERASE AGENT Aventis Pharma S.A. (FR) 2004-01-02 — — EP disclosed
WO-2002076975-A1 CHEMICAL DERIVATIVES AND THEIR USE AS ANTI-TELOMERASE AGENT AVENTIS PHARMA S.A. (FR) 2002-10-03 — — 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 (5 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-12286429-B2 5-oxo-1,2,3,5,8,8a-hexahydroindolizine-3-carboxamide derivatives useful as a factor XIa inhibitors F11, F12, F13A1 KDM4E 462/4885LMNA 1288/4885POLB 3803/4885
US-20070004701-A1 Topoisomerase inhibitors TOP1, TOP2A, TOP2B KDM4E 987/4885LMNA 1934/4885POLB 15/4885
US-20180133225-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF MUC1, CFTR, SLC26A4 KDM4E 4786/4885LMNA 2026/4885POLB 3236/4885
US-20230064443-A1 5-oxo-1,2,3,5,8,8a-hexahydroindolizine-3-carboxamide Derivatives Useful As a Factor XIa Inhibitors F11, F12, F13A1 KDM4E 544/4885LMNA 923/4885POLB 3544/4885
US-20140235634-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF MUC1, CFTR, SLC26A4 KDM4E 4786/4885LMNA 2026/4885POLB 3236/4885

“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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