SCHEMBL861779

SCHEMBL861779

CN1CCN(CC(C)(C)N)CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.39
LMNA P02545 1/20 0.36
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
MAPT P10636 2/20 0.36
RECQL P46063 1/20 0.36
MC4R P32245 1/20 0.34
TDP1 Q9NUW8 1/20 0.33
NCF1 P14598 2/20 0.32
CHKA P35790 2/20 0.32
CA2 P00918 1/20 0.32
PRMT6 Q96LA8 1/20 0.32
PAOX Q6QHF9 1/20 0.32
ALOX15 P16050 1/20 0.32
NOS3 P29474 2/20 0.32
NOS1 P29475 2/20 0.32
NOS2 P35228 1/20 0.32
NR1H2 P55055 1/20 0.32
KDM1A O60341 1/20 0.32
SIGMAR1 Q99720 1/20 0.31

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
SCHEMBL522905 0.89 ALOX15 (0.32) ALOX15
SCHEMBL21117053 0.81 DRD2 (0.38) ALOX15SIGMAR1
SCHEMBL18457919 0.81 ALOX15 (0.35) ALOX15
SCHEMBL9944691 0.81 ALOX15 (0.59) ALDH1A1PRMT6ALOX15SIGMAR1
SCHEMBL18426938 0.80 MAPT (0.36) KDM4EALDH1A1MAPTKDM1A
SCHEMBL11637807 0.79 HTT (0.36) HTTLMNAKDM4EALDH1A1MAPT
SCHEMBL26455581 0.79 HTT (0.41) HTTLMNAKDM4EALDH1A1MAPT
SCHEMBL372272 0.79 SIGMAR1 (0.33) LMNAKDM4EALDH1A1TDP1PRMT6
SCHEMBL736240 0.79 HTT (0.41) HTTLMNAKDM4EALDH1A1MAPT
SCHEMBL23277739 0.78 GRIN2D (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 154 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110392707-A The addition polymerization catalyst of microencapsulation 建筑研究和技术有限公司 2019-10-29 CN claimed
CN-105705489-B Compound as immunomodulator 百时美施贵宝公司 2019-04-26 CN claimed
EP-3041822-A1 COMPOUNDS USEFUL AS IMMUNOMODULATORS Bristol-Myers Squibb Company (US) 2016-07-13 EP claimed
WO-2015034820-A1 COMPOUNDS USEFUL AS IMMUNOMODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2015-03-12 WO claimed
EP-2454303-B1 POLYURIC-BASED CLOTH ADHESIVE MEDICAL ADHESIVE REVOLUTION GMBH (DE) 2014-11-26 EP claimed
EP-2673310-B1 TISSUE ADHESIVE BASED ON NITROGEN-MODIFIED ASPARTATES MEDICAL ADHESIVE REVOLUTION GMBH (DE) 2014-11-19 EP claimed
CN-103415543-A Improved Stability of Polyurethane Polyol Blends Containing Halogenated Olefin Blowing Agents ARKEMA INC 2013-11-27 CN claimed
CN-103347925-A Curable composition DOW GLOBAL TECHNOLOGIES INC 2013-10-09 CN claimed
US-8431565-B2 Substituted imidazoheterocycles CARA THERAPEUTICS, INC. (US) 2013-04-30 US claimed
US-20090149450-A1 SUBSTITUTED IMIDAZOHETEROCYCLES CARA THERAPEUTICS, INC. (US) 2009-06-11 US claimed
JP-62020517-A None JP disclosed
CN-118652225-A Phosphorus-free degradable CaSO (CaSOx resistance)4Small molecular scale inhibitor as well as preparation method and application thereof 石家庄铁道大学 2024-09-17 CN disclosed
US-20240117229-A1 ADHESIVE, LAMINATE, AND PACKAGING MATERIAL DIC CORPORATION (JP) 2024-04-11 US disclosed
US-11945900-B2 Orthodontic articles prepared using a polycarbonate diol, polymerizable compositions, and methods of making the articles 3M INNOVATIVE PROPERTIES COMPANY (US) 2024-04-02 US disclosed
EP-4293091-A1 ADHESIVE, LAMINATE, AND PACKAGING MATERIAL DIC CORPORATION (JP) 2023-12-20 EP disclosed
US-20070264180-A1 METHOD OF DEACIDIZING A GAS BY PARTLY NEUTRALIZED MULTIAMINES INSTITUT FRANCAIS DU PETROLE (FR) 2007-11-15 US disclosed
CN-101031623-A Low bake, low voc conductive primer SHERWIN WILLIAMS CO (US) 2007-09-05 CN disclosed
WO-2006124364-A1 HYDROCARBON OR HYDROFLUOROCARBON BLOWN ASTM E4-84 CLASS I RIGID POLYURETHANE FOAMS BAYER MATERIALSCIENCE LLC (US) 2006-11-23 WO disclosed
US-20060258762-A1 Hydrocarbon or hydrofluorocarbon blown ASTM E-84 class I rigid polyurethane foams BAYER MATERIALSCIENCE LLC 2006-11-16 US disclosed
JP-S6220517-A CATALYST FOR EXCELLENTLY CURABLE POLYURETHANE TOYO SODA MFG CO LTD 1987-01-29 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 (1 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-20090149450-A1 SUBSTITUTED IMIDAZOHETEROCYCLES CNR1, CNR2, TRPV1 HTT 3920/4885LMNA 3582/4885KDM4E 3477/4885

“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.