SCHEMBL1649664

SCHEMBL1649664

CCCCN1C(=O)C(CC2CCCCC2)NC(=O)C12CCN(Cc1ccc3c(c1)OCCO3)CC2

nearest known ligand 0.98

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CCR5 P51681 20/20 0.98
CHRM3 P20309 1/20 0.98
SIGMAR1 Q99720 1/20 0.98
CYP3A4 P08684 1/20 0.68
CYP2D6 P10635 1/20 0.68
CYP2C9 P11712 1/20 0.68

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
SCHEMBL6012888 1.00 CCR5 (0.98) CCR5CHRM3SIGMAR1CYP3A4CYP2D6
SCHEMBL6012730 1.00 CCR5 (0.98) CCR5CHRM3SIGMAR1CYP3A4CYP2D6
SCHEMBL30241423 1.00 CCR5 (0.98) CCR5CHRM3SIGMAR1CYP3A4CYP2D6
SCHEMBL6012483 1.00 CCR5 (0.98) CCR5CHRM3SIGMAR1CYP3A4CYP2D6
Hydrochloric Acid SCHEMBL5612305 0.99 CCR5 (1.00) CCR5CHRM3SIGMAR1CYP3A4CYP2D6
Hydrochloric Acid SCHEMBL5611955 0.99 CCR5 (1.00) CCR5CHRM3SIGMAR1CYP3A4CYP2D6
Hydrochloric Acid SCHEMBL5612796 0.99 CCR5 (1.00) CCR5CHRM3SIGMAR1CYP3A4CYP2D6
Hydrochloric Acid SCHEMBL5612463 0.99 CCR5 (1.00) CCR5CHRM3SIGMAR1CYP3A4CYP2D6
SCHEMBL6012759 0.99 CCR5 (0.97) CCR5CHRM3SIGMAR1CYP3A4CYP2D6
Hydrochloric Acid SCHEMBL5612396 0.98 CCR5 (0.98) CCR5CHRM3SIGMAR1CYP3A4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11844353-B2 Microorganisms for the production of insect pheromones and related compounds PROVIVI, INC. (US) 2023-12-19 US claimed
US-7119091-B2 Triazaspiro[5.5]undecane derivatives and pharmaceutical compositions comprising thereof, as an active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2006-10-10 US claimed
EP-1236726-B1 TRIAZASPIRO 5.5]UNDECANE DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO (JP) 2004-12-01 EP claimed
US-20040097511-A1 Triazaspiro[5.5]undecane derivatives and drugs containing the same as the active ingredient PANASONIC CORPORATION (JP) 2004-05-20 US claimed
EP-1236726-A1 TRIAZASPIRO 5.5]UNDECANE DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2002-09-04 EP claimed
CN-223009445-U Heated massage wheel 浙江热丽科技有限公司 2025-06-24 CN disclosed
US-20250144093-A1 PYRUVATE KINASE ACTIVATORS FOR USE IN TREATING BLOOD DISORDERS AGIOS PHARMACEUTICALS, INC. 2025-05-08 US disclosed
US-20250128208-A1 ALKALINE CATION ENRICHMENT AND WATER ELECTROLYSIS TO PROVIDE CO2 MINERALIZATION AND GLOBAL-SCALE CARBON MANAGEMENT THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2025-04-24 US disclosed
US-12161972-B2 Alkaline cation enrichment and water electrolysis to provide CO2 mineralization and global-scale carbon management THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2024-12-10 US disclosed
US-12133853-B2 Pyruvate kinase activators for use in treating blood disorders AGIOS PHARMACEUTICALS, INC. (US) 2024-11-05 US disclosed
EP-4397394-A1 ALKALINE CATION ENRICHMENT AND WATER ELECTROLYSIS TO PROVIDE COMINERALIZATION AND GLOBAL-SCALE CARBON MANAGEMENT THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2024-07-10 EP disclosed
US-12016935-B2 Methods for detecting CCR2 receptors WASHINGTON UNIVERSITY (US) 2024-06-25 US disclosed
US-20060282123-A1 Electrical devices and anti-scarring agents ANGIOTECH INTERNATIONAL AG (CH) 2006-12-14 US disclosed
US-20060160859-A1 Method for treating HIV infection through co-administration of tipranavir and GW873140 BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2006-07-20 US disclosed
WO-2006060177-A1 METHOD FOR TREATING HIV INFECTION THROUGH CO-ADMINISTRATION OF TIPRANAVIR AND GW873140 BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2006-06-08 WO disclosed
US-20050196421-A1 Polymer compositions and methods for their use ANGIOTECH INTERNATIONAL AG (CH) 2005-09-08 US disclosed
US-20040260318-A1 Anastomotic connector devices ANGIOTECH INTERNATIONAL AG (CH) 2004-12-23 US disclosed
EP-1236726-B1 TRIAZASPIRO 5.5]UNDECANE DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO (JP) 2004-12-01 EP disclosed
EP-1438962-A1 DRUGS COMPRISING COMBINATION OF TRIAZASPIRO 5,5 U NDECANE DERIVATIVE WITH CYTOCHROME P450 ISOZYME 3A4 INHIBITOR AND/OR P−GLYCOPROTEIN INHIBITOR ONO PHARMACEUTICAL CO., LTD. (JP) 2004-07-21 EP disclosed
EP-1236726-A1 TRIAZASPIRO 5.5]UNDECANE DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2002-09-04 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 (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-11844353-B2 Microorganisms for the production of insect pheromones and related compounds FASN, ACSL4, FADS1 CCR5 258/4885CHRM3 726/4885SIGMAR1 3079/4885
US-20060160859-A1 Method for treating HIV infection through co-administration of tipranavir and GW873140 NAA40, TRIM25, CD4 CCR5 14/4885CHRM3 3462/4885SIGMAR1 2274/4885
US-12016935-B2 Methods for detecting CCR2 receptors CCR2, CCR1, CCR5 CCR5 3/4885CHRM3 466/4885SIGMAR1 345/4885
US-20040097511-A1 Triazaspiro[5.5]undecane derivatives and drugs containing the same as the active ingredient CXCR5, CCL11, ACKR3 CCR5 5/4885CHRM3 2484/4885SIGMAR1 97/4885
US-12133853-B2 Pyruvate kinase activators for use in treating blood disorders PDK1, PDK2, PDK3 CCR5 3909/4885CHRM3 3011/4885SIGMAR1 3840/4885
US-20250144093-A1 PYRUVATE KINASE ACTIVATORS FOR USE IN TREATING BLOOD DISORDERS PDK1, PDK2, PDK3 CCR5 3909/4885CHRM3 3011/4885SIGMAR1 3840/4885

“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.