SCHEMBL15740982

SCHEMBL15740982

C#CCCCN1CCCCC1

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 9/20 0.56
MAPT P10636 2/20 0.50
CYP1A2 P05177 1/20 0.43
MAPK1 P28482 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
POLB P06746 2/20 0.38
SIGMAR1 Q99720 1/20 0.37
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL15485592 0.98 HRH3 (0.52) HRH3MAPTCYP1A2MAPK1SMN1; SMN2
SCHEMBL15485534 0.93 HRH3 (0.61) HRH3MAPTCYP1A2MAPK1SMN1; SMN2
SCHEMBL23191089 0.93
SCHEMBL1037242 0.85 HRH3 (0.48) HRH3MAPTCYP1A2MAPK1SMN1; SMN2
SCHEMBL20858732 0.85 HRH3 (0.48) HRH3MAPTCYP1A2MAPK1SMN1; SMN2
SCHEMBL25432585 0.85 HRH3 (0.48) HRH3MAPTCYP1A2MAPK1SMN1; SMN2
Oxalic Acid SCHEMBL15485864 0.82 SMN1; SMN2 (0.52) HRH3MAPTCYP1A2MAPK1SMN1; SMN2
SCHEMBL5325568 0.82 MAPT (0.44) HRH3MAPTSIGMAR1
SCHEMBL25433068 0.82 POLB (0.48) HRH3MAPTSMN1; SMN2POLBALDH1A1
SCHEMBL3770379 0.82

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250304576-A1 IKK INHIBITORS CANCER RESEARCH TECH LTD (GB) 2025-10-02 US disclosed
CN-105189478-B Uracil deoxyriboside triphosphatase inhibitor 南加州大学 2019-10-22 CN disclosed
CN-105111151-B Aminopyridine derivative as PPAR- gamma modulators 成都理工大学 2018-09-28 CN disclosed
US-20180148452-A1 TOLL-LIKE RECEPTOR-7 AGONIST MEDSHINE DISCOVERY INC. (CN) 2018-05-31 US disclosed
US-20180148452-A1 TOLL-LIKE RECEPTOR-7 AGONIST MEDSHINE DISCOVERY INC. (CN) 2018-05-31 US disclosed
US-20180140695-A1 NOVEL COMPOUNDS GLAXOSMITHKLINE LLC 2018-05-24 US disclosed
US-9907847-B2 Pyrrolopyrimidines as therapeutic agents for the treatment of diseases GLAXOSMITHKLINE LLC (US) 2018-03-06 US disclosed
EP-2922549-B1 NOVEL COMPOUNDS GLAXOSMITHKLINE LLC (US) 2017-06-21 EP disclosed
US-20170080085-A1 NOVEL COMPOUNDS GLAXOSMITHKLINE LLC (US) 2017-03-23 US disclosed
US-9540383-B2 Pyrrolopyrimidines as therapeutic agents for the treatment of diseases GLAXOSMITHKLINE LLC (US) 2017-01-10 US disclosed
WO-2016107536-A1 TOLL-LIKE RECEPTOR-7 AGONIST 南京明德新药研发股份有限公司 2016-07-07 WO disclosed
CN-105732635-A Toll-like receptor 7 agonist 南京明德新药研发股份有限公司 2016-07-06 CN disclosed
CN-105111151-A Aminopyrimidine derivative used as PPAR-gamma regulator UNIV CHENGDU TECHNOLOGY 2015-12-02 CN disclosed
US-20150284396-A1 NOVEL COMPOUNDS GLAXOSMITHKLINE LLC 2015-10-08 US disclosed
EP-2922549-A1 NOVEL COMPOUNDS Glaxosmithkline LLC (US) 2015-09-30 EP disclosed
WO-2014081645-A1 NOVEL COMPOUNDS GLAXOSMITHKLINE LLC (US) 2014-05-30 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-20250304576-A1 IKK INHIBITORS NFKBIA, IKBKE, IKBKB HRH3 3648/4885MAPT 1448/4885CYP1A2 3771/4885
US-20180148452-A1 TOLL-LIKE RECEPTOR-7 AGONIST TLR7, TLR9, TLR1 HRH3 42/4885MAPT 4366/4885CYP1A2 2547/4885
US-20150284396-A1 NOVEL COMPOUNDS IFNG, IFNAR1, IRF3 HRH3 7/4885MAPT 4842/4885CYP1A2 1671/4885
US-20170080085-A1 NOVEL COMPOUNDS IFNG, IFNAR1, IRF3 HRH3 7/4885MAPT 4842/4885CYP1A2 1671/4885
US-20180140695-A1 NOVEL COMPOUNDS IFNG, IFNAR1, IRF3 HRH3 7/4885MAPT 4842/4885CYP1A2 1671/4885

“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.