SCHEMBL2359490

SCHEMBL2359490

CC(C)n1cnc2c(NCCc3c[nH]c4ccc(Cl)cc34)nc(-c3cccnc3)nc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 6/20 0.52
▸ CYP3A4 P08684 6/20 0.52
▸ CYP2D6 P10635 6/20 0.52
▸ CYP2C19 P33261 6/20 0.52
▸ CLK4 Q9HAZ1 5/20 0.52
▸ USP2 O75604 5/20 0.52
▸ CYP2C9 P11712 4/20 0.52
▸ HSD17B10 Q99714 3/20 0.52
▸ ALDH1A1 P00352 3/20 0.52
▸ MEN1 O00255 3/20 0.52
▸ LMNA P02545 3/20 0.52
▸ KMT2A Q03164 3/20 0.52
▸ TSHR P16473 1/20 0.52
▸ GBA1 P04062 1/20 0.51
▸ HPGD P15428 1/20 0.47
▸ CDK2 P24941 3/20 0.47
▸ CCNE2 O96020 2/20 0.47
▸ CCNE1 P24864 2/20 0.47
▸ ALOX15 P16050 2/20 0.46
▸ MAPK1 P28482 2/20 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
SCHEMBL2358538 0.92 CYP1A2 (0.53) CYP1A2CYP3A4CYP2D6CYP2C19CLK4
SCHEMBL2359100 0.91 CYP1A2 (0.52) CYP1A2CYP3A4CYP2D6CYP2C19CLK4
SCHEMBL13282305 0.91 CYP1A2 (0.52) CYP1A2CYP3A4CYP2D6CYP2C19CLK4
SCHEMBL2319820 0.90 GBA1 (0.64) CYP1A2CYP3A4CYP2D6CYP2C19CLK4
SCHEMBL2314203 0.85 CYP1A2 (0.59) CYP1A2CYP3A4CYP2D6CYP2C19CLK4
SCHEMBL31747035 0.81 CDK2 (0.46) CYP1A2CYP3A4CYP2D6CYP2C19CLK4
SCHEMBL20542259 0.81 CDK2 (0.46) CYP1A2CYP3A4CYP2D6CYP2C19CLK4
SCHEMBL29382910 0.80 CCNE2 (0.56) CYP1A2CYP3A4CYP2D6CYP2C19CLK4
SCHEMBL2358460 0.80 CCNE2 (0.56) CYP1A2CYP3A4CYP2D6CYP2C19CLK4
SCHEMBL15682224 0.80 CCNE2 (0.46) CYP1A2CYP3A4CYP2D6CYP2C19CLK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210187033-A1 COMPOUNDS THAT EXPAND HEMATOPOIETIC STEM CELLS NOVARTIS AG (CH) 2021-06-24 — — US claimed
EP-2350078-B1 COMPOUNDS THAT EXPAND HEMATOPOIETIC STEM CELLS NOVARTIS AG (CH) 2019-04-17 — — EP claimed
US-20170239296-A1 COMPOUNDS THAT EXPAND HEMATOPOIETIC STEM CELLS NOVARTIS AG (CH) 2017-08-24 — — US claimed
US-9580426-B2 Compounds that expand hematopoietic stem cells NOVARTIS AG (CH) 2017-02-28 — — US claimed
US-9175266-B2 Enhancement of natural killer (NK) cell proliferation and activity GAMIDA CELL LTD. (IL) 2015-11-03 — — US claimed
US-8927281-B2 Method for expanding hematopoietic stem cells IRM LLC (BM) 2015-01-06 — — US claimed
US-20140114070-A1 COMPOUNDS THAT EXPAND HEMATOPOIETIC STEM CELLS THE SCRIPPS RESEARCH INSTITUTE (US) 2014-04-24 — — US claimed
US-20140023626-A1 Enhancement of Natural Killer (NK) Cell Proliferation and Activity GAMIDA CELL INC. 2014-01-23 — — US claimed
US-20140023623-A1 Methods of Culturing and Expanding Mesenchymal Stem Cells and Isolated Cell Populations Generated Thereby GAMIDA CELL INC. 2014-01-23 — — US claimed
CN-102203096-A Compounds that expand hematopoietic stem cells IRM LLC 2011-09-28 — — CN claimed
EP-2350078-A2 COMPOUNDS THAT EXPAND HEMATOPOIETIC STEM CELLS IRM LLC (BM) 2011-08-03 — — EP claimed
US-20100183564-A1 COMPOUNDS THAT EXPAND HEMATOPOIETIC STEM CELLS IRM LLC (BM) 2010-07-22 — — US claimed
WO-2010059401-A2 COMPOUNDS THAT EXPAND HEMATOPOIETIC STEM CELLS IRM LLC (BM) 2010-05-27 — — WO claimed
EP-3524604-B1 EXPANDED HEMATOPOIETIC STEM CELLS FROM CORD BLOOD AND THEIR THERAPEUTIC USE NOVARTIS AG (CH) 2023-03-29 — — EP disclosed
US-20210187033-A1 COMPOUNDS THAT EXPAND HEMATOPOIETIC STEM CELLS NOVARTIS AG (CH) 2021-06-24 — — US disclosed
US-20210187033-A1 COMPOUNDS THAT EXPAND HEMATOPOIETIC STEM CELLS NOVARTIS AG (CH) 2021-06-24 — — US disclosed
US-20100183564-A1 COMPOUNDS THAT EXPAND HEMATOPOIETIC STEM CELLS IRM LLC (BM) 2010-07-22 — — US disclosed
US-20100183564-A1 COMPOUNDS THAT EXPAND HEMATOPOIETIC STEM CELLS IRM LLC (BM) 2010-07-22 — — US disclosed
WO-2010059401-A2 COMPOUNDS THAT EXPAND HEMATOPOIETIC STEM CELLS IRM LLC (BM) 2010-05-27 — — WO disclosed
WO-2010059401-A2 COMPOUNDS THAT EXPAND HEMATOPOIETIC STEM CELLS IRM LLC (BM) 2010-05-27 — — 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 (6 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-20170239296-A1 COMPOUNDS THAT EXPAND HEMATOPOIETIC STEM CELLS CD47, HCLS1, CD74 CYP1A2 4564/4885CYP3A4 4844/4885CYP2D6 4662/4885
US-20210187033-A1 COMPOUNDS THAT EXPAND HEMATOPOIETIC STEM CELLS CD47, HCLS1, CD74 CYP1A2 4564/4885CYP3A4 4844/4885CYP2D6 4662/4885
US-20140114070-A1 COMPOUNDS THAT EXPAND HEMATOPOIETIC STEM CELLS CD47, HCLS1, CD74 CYP1A2 4564/4885CYP3A4 4844/4885CYP2D6 4662/4885
US-20140023626-A1 Enhancement of Natural Killer (NK) Cell Proliferation and Activity PBK, IL2, AHR CYP1A2 481/4885CYP3A4 484/4885CYP2D6 917/4885
US-20100183564-A1 COMPOUNDS THAT EXPAND HEMATOPOIETIC STEM CELLS CD47, HCLS1, CD74 CYP1A2 4564/4885CYP3A4 4844/4885CYP2D6 4662/4885
US-20140023623-A1 Methods of Culturing and Expanding Mesenchymal Stem Cells and Isolated Cell Populations Generated Thereby AHR, HGF, MTNR1A CYP1A2 532/4885CYP3A4 1379/4885CYP2D6 929/4885

“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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