SCHEMBL4254382

SCHEMBL4254382

CC1(C)CNCC(C)(C)C1=O

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.33

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 SCHEMBL4254389 0.97 HSD17B10 (0.38) HSD17B10SMN1; SMN2
SCHEMBL2263815 0.75 HSD17B10 (0.54) HSD17B10SMN1; SMN2
Hydrochloric Acid SCHEMBL4347112 0.73 HSD17B10 (0.52) HSD17B10SMN1; SMN2
SCHEMBL2692984 0.69 KDM4E (0.31) SMN1; SMN2
SCHEMBL3132852 0.69
SCHEMBL503928 0.67
SCHEMBL10453358 0.67 SMN1; SMN2 (0.33) SMN1; SMN2
SCHEMBL1876188 0.66 CRBN (0.32) SMN1; SMN2
Hydrochloric Acid SCHEMBL3022081 0.66 HTR2A (0.39)
SCHEMBL1058536 0.65 KDM4E (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3124482-B1 QUINOLINE DERIVATIVES AS SMO INHIBITORS GUANGDONG ZHONGSHENG PHARMACEUTICAL CO LTD (CN) 2019-09-11 EP disclosed
US-9938292-B2 Quinoline derivatives as SMO inhibitors GUANGDONG ZHONGSHENG PHARMACEUTICAL CO., LTD (CN) 2018-04-10 US disclosed
US-9938292-B2 Quinoline derivatives as SMO inhibitors GUANGDONG ZHONGSHENG PHARMACEUTICAL CO., LTD (CN) 2018-04-10 US disclosed
US-20170174703-A1 QUINOLINE DERIVATIVES AS SMO INHIBITORS GUANGDONG ZHONGSHENG PHARMACEUTICAL CO., LTD (CN) 2017-06-22 US disclosed
US-20170174703-A1 QUINOLINE DERIVATIVES AS SMO INHIBITORS GUANGDONG ZHONGSHENG PHARMACEUTICAL CO., LTD (CN) 2017-06-22 US disclosed
EP-3124482-A1 QUINOLINE DERIVATIVES AS SMO INHIBITORS GUANGDONG ZHONGSHENG PHARMACEUTICAL CO., LTD (CN) 2017-02-01 EP disclosed
WO-2015144001-A1 QUINOLINE DERIVATIVES AS SMO INHIBITORS 南京明德新药研发股份有限公司 2015-10-01 WO disclosed
US-7608630-B2 Prepared by extracting fungi Marasmius androsaceus L.es Fr with an organic solvent, an aqueous organic solvent or water, and concentrating the obtained extractive; use in treatment of cardiovascular disorders HAINAN YANGPU NEW SPECIAL PHARMACEUTICAL CO., LTD. (CN) 2009-10-27 US disclosed
US-7608630-B2 Prepared by extracting fungi Marasmius androsaceus L.es Fr with an organic solvent, an aqueous organic solvent or water, and concentrating the obtained extractive; use in treatment of cardiovascular disorders HAINAN YANGPU NEW SPECIAL PHARMACEUTICAL CO., LTD. (CN) 2009-10-27 US disclosed
US-7608630-B2 Prepared by extracting fungi Marasmius androsaceus L.es Fr with an organic solvent, an aqueous organic solvent or water, and concentrating the obtained extractive; use in treatment of cardiovascular disorders HAINAN YANGPU NEW SPECIAL PHARMACEUTICAL CO., LTD. (CN) 2009-10-27 US disclosed
US-20090253742-A1 MARASMIUS ANDROSACEUS L.ES FR EXTRACT, PIPERIDONE DERIVATIVE, AND THEIR USE FOR THE PREPARATION OF ANTIHYPERTENSIVES HAINAN YANGPU NEW SPECIAL PHARMACEUTICAL CO., LTD. (CN) 2009-10-08 US disclosed
US-20090253742-A1 MARASMIUS ANDROSACEUS L.ES FR EXTRACT, PIPERIDONE DERIVATIVE, AND THEIR USE FOR THE PREPARATION OF ANTIHYPERTENSIVES HAINAN YANGPU NEW SPECIAL PHARMACEUTICAL CO., LTD. (CN) 2009-10-08 US disclosed
US-20090253742-A1 MARASMIUS ANDROSACEUS L.ES FR EXTRACT, PIPERIDONE DERIVATIVE, AND THEIR USE FOR THE PREPARATION OF ANTIHYPERTENSIVES HAINAN YANGPU NEW SPECIAL PHARMACEUTICAL CO., LTD. (CN) 2009-10-08 US disclosed
US-20070160625-A1 Marasmius androsaceus l.es fr extract, piperidone derivative, and their use for the preparation of antihypertensives HAINAN YANGPU NEW SPECIAL PHARMACEUTICAL CO., LTD. (CN) 2007-07-12 US disclosed
US-20070160625-A1 Marasmius androsaceus l.es fr extract, piperidone derivative, and their use for the preparation of antihypertensives HAINAN YANGPU NEW SPECIAL PHARMACEUTICAL CO., LTD. (CN) 2007-07-12 US disclosed
US-20070160625-A1 Marasmius androsaceus l.es fr extract, piperidone derivative, and their use for the preparation of antihypertensives HAINAN YANGPU NEW SPECIAL PHARMACEUTICAL CO., LTD. (CN) 2007-07-12 US disclosed
CN-1918123-A Marasmius androsaceus extract, piperidone derivative and application thereof in preparation of antihypertensive drugs TUOLIN MEDICINE TECH CO LTD BE (CN) 2007-02-21 CN disclosed
EP-1710235-A1 EXTRACTS OF MARASMINS ANDROSACEUS L.ES, PIPERDINONE DERIVATIVES AND THE USE AS ANTIHYPERTENSIVE AGENTS Beijing Tuolin Medicine Science and Technology Co., Ltd. (CN) 2006-10-11 EP 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-20090253742-A1 MARASMIUS ANDROSACEUS L.ES FR EXTRACT, PIPERIDONE DERIVATIVE, AND THEIR USE FOR THE PREPARATION OF ANTIHYPERTENSIVES REN, PTGIS, EDNRA HSD17B10 1579/4885SMN1; SMN2 2532/4885
US-20170174703-A1 QUINOLINE DERIVATIVES AS SMO INHIBITORS SMO, GLI1, SHH HSD17B10 2934/4885SMN1; SMN2 4029/4885
US-20070160625-A1 Marasmius androsaceus l.es fr extract, piperidone derivative, and their use for the preparation of antihypertensives REN, PTGIS, EDNRA HSD17B10 1579/4885SMN1; SMN2 2532/4885

“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.