SCHEMBL932896

SCHEMBL932896

CC(C)=CCCC(C)=CCCC(C)=CCN

nearest known ligand 0.73

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.73
SQLE Q14534 7/20 0.64
MAPT P10636 2/20 0.64
MEN1 O00255 2/20 0.64
CYP3A4 P08684 2/20 0.64
ALOX15 P16050 2/20 0.64
ALDH1A1 P00352 1/20 0.64
UGT1A1 P22309 1/20 0.64
KDM4E B2RXH2 1/20 0.57
POLB P06746 1/20 0.52
FNTA P49354 1/20 0.52
FNTB P49356 1/20 0.52

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
SCHEMBL2769830 1.00 KMT2A (0.73) KMT2ASQLEMAPTMEN1CYP3A4
SCHEMBL20624673 1.00 KMT2A (0.73) KMT2ASQLEMAPTMEN1CYP3A4
SCHEMBL30531903 1.00 KMT2A (0.73) KMT2ASQLEMAPTMEN1CYP3A4
SCHEMBL11892318 1.00 KMT2A (0.73) KMT2ASQLEMAPTMEN1CYP3A4
SCHEMBL21260659 1.00 KMT2A (0.73) KMT2ASQLEMAPTMEN1CYP3A4
SCHEMBL30531904 1.00 KMT2A (0.73) KMT2ASQLEMAPTMEN1CYP3A4
SCHEMBL2495183 1.00 KMT2A (0.73) KMT2ASQLEMAPTMEN1CYP3A4
SCHEMBL2495184 1.00 KMT2A (0.73) KMT2ASQLEMAPTMEN1CYP3A4
Hydrochloric Acid SCHEMBL8940577 0.98 KMT2A (0.70) KMT2ASQLEMAPTMEN1CYP3A4
SCHEMBL352058 0.98 KMT2A (0.68) KMT2ASQLEMAPTMEN1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115433728-B Eugenia caryophyllata sesquiterpene synthase and application thereof 中国中医科学院中药研究所 2024-11-05 CN claimed
CN-118853643-A Biota orientalis sesquiterpene synthase PoTPS1 and encoding gene and application thereof 北京化工大学 2024-10-29 CN claimed
CN-117986069-A Method for producing squalene and squalane based on farnesene fermentation broth and application of method 中国科学院青岛生物能源与过程研究所 2024-05-07 CN claimed
US-20220016046-A1 PERMANENTLY CHARGED SODIUM AND CALCIUM CHANNEL BLOCKERS AS ANTI-INFLAMMATORY AGENTS CHILDREN'S MEDICAL CENTER CORPORATION (US) 2022-01-20 US claimed
US-20210290561-A1 PERMANENTLY CHARGED SODIUM AND CALCIUM CHANNEL BLOCKERS AS ANTI-INFLAMMATORY AGENTS CHILDREN'S MEDICAL CENTER CORPORATION (US) 2021-09-23 US claimed
US-20190284125-A1 Amine Derivatives of The Beta-Farnesene CLARIANT INTERNATIONAL LTD. (CH) 2019-09-19 US claimed
US-10201510-B2 Compositions and methods for treatment of neurological symptoms associated with alcohol-withdrawal and for convulsive seizure OREGON HEALTH & SCIENCE UNIVERSITY (US) 2019-02-12 US claimed
US-20120172429-A1 PERMANENTLY CHARGED SODIUM AND CALCIUM CHANNEL BLOCKERS AS ANTI- INFLAMMATORY AGENTS THE GENERAL HOSPITAL CORPORATION 2012-07-05 US claimed
EP-2451944-A1 PERMANENTLY CHARGED SODIUM AND CALCIUM CHANNEL BLOCKERS AS ANTI-INFLAMMATORY AGENTS President and Fellows of Harvard College (US) 2012-05-16 EP claimed
WO-2011006073-A1 PERMANENTLY CHARGED SODIUM AND CALCIUM CHANNEL BLOCKERS AS ANTI-INFLAMMATORY AGENTS PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2011-01-13 WO claimed
US-20080286209-A1 Compositions and Methods for Treatment of Neurological Symptoms Associated with Alcohol-Withdrawal and for Consulsive Seizure OREGON HEALTH & SCIENCE UNIVERSITY (US) 2008-11-20 US claimed
WO-2006086372-A2 COMPOSITIONS AND METHODS FOR TREATMENT OF NEUROLOGICAL SYMPTOMS ASSOCIATED WITH ALCOHOL-WITHDRAWAL AND FOR CONVULSIVE SEIZURE OREGON HEALTH & SCIENCE UNIVERSITY (US) 2006-08-17 WO claimed
JP-57106644-A None JP disclosed
JP-10218764-A None JP disclosed
JP-11130670-A None JP disclosed
CN-114746434-B Antibiotic compounds 莱顿大学 2025-02-21 CN disclosed
EP-0194901-A2 Isoprenoidamine derivatives, compositions containing them, their preparation, and their use SHIONOGI & CO., LTD. (JP) 1986-09-17 EP disclosed
US-4520029-A ANTIINFLAMMATORY AND ANTIULCER AGENTS KOTOBUKI SEIYAKU CO., LTD. (JP) 1985-05-28 US disclosed
US-4520029-A ANTIINFLAMMATORY AND ANTIULCER AGENTS KOTOBUKI SEIYAKU CO., LTD. (JP) 1985-05-28 US disclosed
JP-S57106644-A FARNESENCE DERIVATIVE, MUCOSA STABILIZER COMPRISING IT AS ACTIVE INGREDIENT, AND ITS PREPARATION KOTOBUKI SEIYAKU KK 1982-07-02 JP 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-20120172429-A1 PERMANENTLY CHARGED SODIUM AND CALCIUM CHANNEL BLOCKERS AS ANTI- INFLAMMATORY AGENTS TRPV1, CACNA1B, ORAI1 KMT2A 2190/4885SQLE 3584/4885MAPT 725/4885
US-10201510-B2 Compositions and methods for treatment of neurological symptoms associated with alcohol-withdrawal and for convulsive seizure ADH1C, ADH1A, CHRNA10 KMT2A 1291/4885SQLE 217/4885MAPT 295/4885
US-20190284125-A1 Amine Derivatives of The Beta-Farnesene FNTA, FNTB, FDPS KMT2A 1676/4885SQLE 8/4885MAPT 900/4885
US-20080286209-A1 Compositions and Methods for Treatment of Neurological Symptoms Associated with Alcohol-Withdrawal and for Consulsive Seizure PNMT, ADH1A, CHRNA10 KMT2A 1287/4885SQLE 464/4885MAPT 524/4885
US-20210290561-A1 PERMANENTLY CHARGED SODIUM AND CALCIUM CHANNEL BLOCKERS AS ANTI-INFLAMMATORY AGENTS TRPV1, CACNA1B, ORAI1 KMT2A 2190/4885SQLE 3584/4885MAPT 725/4885
US-20220016046-A1 PERMANENTLY CHARGED SODIUM AND CALCIUM CHANNEL BLOCKERS AS ANTI-INFLAMMATORY AGENTS CACNA1B, TRPV1, ORAI1 KMT2A 2196/4885SQLE 3640/4885MAPT 716/4885

“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.