SCHEMBL6948020

SCHEMBL6948020

NC1CCN(CCCCCCO)CC1

nearest known ligand 0.63

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 6/20 0.63
GNAO1 P09471 6/20 0.63
GNAI1 P63096 6/20 0.63
SPHK1 Q9NYA1 1/20 0.42
HRH3 Q9Y5N1 2/20 0.39
HRH2 P25021 1/20 0.38
HRH1 P35367 1/20 0.38
HTR4 Q13639 2/20 0.36
CHRM2 P08172 5/20 0.35
CHRM4 P08173 5/20 0.35
CHRM5 P08912 5/20 0.35
CHRM1 P11229 5/20 0.35
CHRM3 P20309 5/20 0.35
DRD2 P14416 2/20 0.35
DRD4 P21917 2/20 0.35
DRD3 P35462 2/20 0.35

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
SCHEMBL8108223 1.00 GNAI3 (0.63) GNAI3GNAO1GNAI1SPHK1HRH3
SCHEMBL6944303 1.00 GNAI3 (0.63) GNAI3GNAO1GNAI1SPHK1HRH3
Hydrochloric Acid SCHEMBL2824891 0.98 GNAO1 (0.67) GNAI3GNAO1GNAI1SPHK1HRH3
SCHEMBL6943841 0.98 GNAI3 (0.60) GNAI3GNAO1GNAI1SPHK1HRH3
SCHEMBL598694 0.91 GNAI3 (0.57) GNAI3GNAO1GNAI1SPHK1HRH3
SCHEMBL13547199 0.84 GNAI3 (0.50) GNAI3GNAO1GNAI1SPHK1HRH3
SCHEMBL916237 0.82 GNAI3 (0.50) GNAI3GNAO1GNAI1SPHK1HRH3
SCHEMBL8022494 0.81 SPHK1 (0.44) GNAI3GNAO1GNAI1SPHK1HRH3
SCHEMBL8015299 0.81 SPHK1 (0.44) GNAI3GNAO1GNAI1SPHK1HRH3
Hydrochloric Acid SCHEMBL2826668 0.80 GNAI3 (0.53) GNAI3GNAO1GNAI1SPHK1HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2699546-B1 GAS CAPTURE PROCESS COMMONWEALTH SCIENT & INDUSTRIAL RESEARCH ORGANISATION (AU) 2019-06-26 EP disclosed
US-9409122-B2 Gas capture process COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2016-08-09 US disclosed
US-9409122-B2 Gas capture process COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2016-08-09 US disclosed
US-20140127103-A1 GAS CAPTURE PROCESS COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2014-05-08 US disclosed
US-20140127103-A1 GAS CAPTURE PROCESS COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2014-05-08 US disclosed
CN-1143858-C 6, 9-disubstituted 2- [ trans- (aminocyclohexyl) amino ] purines, compositions and uses thereof ������ҩ�����޹�˾ 2004-03-31 CN disclosed
US-6642231-B2 Antineoplastic agents, treatment for neuronal injury and degeneration AVENTIS PHARMACEUTICALS INC. 2003-11-04 US disclosed
EP-1056744-B1 6,9-DISUBSTITUTED 2- TRANS-(4- AMINOCYCLOHEXYL) AMINO]PURINES AVENTIS PHARMA INC (US) 2003-10-22 EP disclosed
US-20030105098-A1 6,9-disubstituted 2-[trans-(4-aminocyclohexyl) amino] purines AVENTISUB II INC. 2003-06-05 US disclosed
US-6479487-B1 INHIBIT CYCLIN DEPENDENT KINASES, PARTICULARLY CDK-2; ANTIAPOPTOSIS AGENT; INHIBITS DEVELOPMENT OF NEOPLASMS AVENTIS PHARMACEUTICALS INC. 2002-11-12 US disclosed
CN-1292789-A 6,9-disubstituted 2-[trans-(4-aminocyclohexyl) amino] purines AWANDIS PHARMACEUTICAL CORP (US) 2001-04-25 CN disclosed
EP-1056744-A1 6,9-DISUBSTITUTED 2- TRANS-(4- AMINOCYCLOHEXYL) AMINO]PURINES Aventis Pharmaceuticals Inc. (US) 2000-12-06 EP disclosed
WO-1999043675-A1 6,9-DISUBSTITUTED 2-[TRANS-(4- AMINOCYCLOHEXYL) AMINO]PURINES AVENTIS PHARMACEUTICALS INC. (US) 1999-09-02 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 (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-20030105098-A1 6,9-disubstituted 2-[trans-(4-aminocyclohexyl) amino] purines CDK6, CDK5, CDK2 GNAI3 2099/4885GNAO1 2886/4885GNAI1 2256/4885

“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.