SCHEMBL6044069

SCHEMBL6044069

[CH2]CCN1CCC(OC)C1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.35
GRIN1 Q05586 1/20 0.34
GRIN2B Q13224 1/20 0.34
CARM1 Q86X55 1/20 0.32
PRMT6 Q96LA8 1/20 0.32
KCNH2 Q12809 1/20 0.31
MCHR1 Q99705 1/20 0.31
LMNA P02545 1/20 0.31
HRH3 Q9Y5N1 1/20 0.30
DRD2 P14416 1/20 0.30
BACE1 P56817 1/20 0.30

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
SCHEMBL26981434 1.00 LTA4H (0.35) LTA4HGRIN1GRIN2BCARM1PRMT6
SCHEMBL6043388 0.89 LTA4H (0.33) LTA4HGRIN1GRIN2B
SCHEMBL26981363 0.83
SCHEMBL771319 0.83
SCHEMBL10152381 0.82 DRD2 (0.41) HRH3DRD2
SCHEMBL15685442 0.82 DRD2 (0.41) HRH3DRD2
SCHEMBL15133969 0.82 DRD2 (0.41) HRH3DRD2
SCHEMBL25363068 0.80 ALOX15 (0.41) LTA4HGRIN1GRIN2BCARM1PRMT6
SCHEMBL15685469 0.80 SLC18A3 (0.37) LTA4HGRIN1GRIN2B
SCHEMBL6043375 0.80 GRIN1 (0.37) LTA4HGRIN1GRIN2BKCNH2MCHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240166669-A1 QUINAZOLINE AMINE DERIVATIVES AS KRAS INHIBITORS NIKANG THERAPEUTICS, INC. 2024-05-23 US disclosed
CN-117255684-A Quinazolinamine derivatives as KRAS inhibitors 尼坎治疗公司 2023-12-19 CN disclosed
EP-2805956-B1 GAMBOGENIC ACID DERIVATIVES, PREPARATION METHOD AND APPLICATION THEREOF NINTH PEOPLES HOSPITAL SCHOOL MEDICINE SHANGHAI JIAO TONG UNIV (CN) 2018-12-26 EP disclosed
EP-2805956-A1 GAMBOGENIC ACID DERIVATIVES, PREPARATION METHOD AND APPLICATION THEREOF Ninth People's Hospital, School Medicine Shanghai Jiao Tong University (CN) 2014-11-26 EP disclosed
US-20060089355-A1 Methods of treating alzheimer's disease using aromatically substituted w-amino-alkanoic acid amides and alkanoic acid diamides ELAN PHARMACEUTICALS, INC. 2006-04-27 US disclosed
WO-2003103652-A1 METHODS OF TREATING ALZHEIMER’S DISEASE USING AROMATICALLY SUBSTITUTED ω-AMINO-ALKANOIC ACID AMIDES AND ALKANOIC ACID DIAMIDES ELAN PHARMACEUTICALS, INC. (US) 2003-12-18 WO disclosed
US-5641778-A EXHIBIT RENIN-INHIBITING PROPERTIES AND CAN BE USED AS ANTIHYPERTENSIVE AGENTS CIBA-GEIGY CORPORATION (US) 1997-06-24 US disclosed
EP-0716077-A1 Aromatically substituted omega amino alcanoic acid amides and alcanoic diamides and their use as renine inhibitors CIBA-GEIGY AG (CH) 1996-06-12 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 (2 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-20060089355-A1 Methods of treating alzheimer's disease using aromatically substituted w-amino-alkanoic acid amides and alkanoic acid diamides APP, BACE1, BACE2 LTA4H 900/4885GRIN1 673/4885GRIN2B 699/4885
US-20240166669-A1 QUINAZOLINE AMINE DERIVATIVES AS KRAS INHIBITORS KRAS, NRAS, HRAS LTA4H 4413/4885GRIN1 2592/4885GRIN2B 3729/4885

“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.