SCHEMBL995030

SCHEMBL995030

CC(C)(O)CC[C@H](C[C@H](O)[C@H](Cc1cccc(F)c1)NC(=O)c1cnc2ccccc2n1)C(N)=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 20/20 1.00
CHRM2 P08172 1/20 1.00
CCR5 P51681 1/20 1.00

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
SCHEMBL29709355 1.00 CCR1 (1.00) CCR1CHRM2CCR5
SCHEMBL30059121 1.00 CCR1 (1.00) CCR1CHRM2CCR5
SCHEMBL993794 0.94 CCR1 (0.90) CCR1CHRM2CCR5
SCHEMBL18776064 0.93 CCR1 (0.87) CCR1CHRM2CCR5
SCHEMBL9910989 0.91 CCR1 (0.87) CCR1CHRM2CCR5
SCHEMBL993584 0.91 CCR1 (0.83) CCR1CHRM2CCR5
SCHEMBL6807717 0.90 CCR1 (0.82) CCR1CHRM2CCR5
SCHEMBL6251094 0.90 CCR1 (0.82) CCR1CHRM2CCR5
SCHEMBL6248473 0.90 CCR1 (0.82) CCR1CHRM2CCR5
SCHEMBL6249065 0.90 CCR1 (0.81) CCR1CHRM2CCR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1404300-B1 PHARMACEUTICAL COMPOSITIONS OF DISPERSIONS OF DRUGS AND NEUTRAL POLYMERS PFIZER PROD INC (US) 2009-09-30 EP claimed
WO-2024089691-A1 MODULATORS AND USES THEREOF HADASIT MEDICAL RESEARCH SERVICES AND DEVELOPMENT LTD (IL) 2024-05-02 WO disclosed
EP-2614848-B1 Inhaler and capsule for an inhaler BOEHRINGER INGELHEIM INT (DE) 2020-07-01 EP disclosed
US-10220165-B2 Inhalator and capsule for an inhalator BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2019-03-05 US disclosed
WO-2017070431-A1 USE OF CCR1 ANTAGONISTS AS A TREATMENT FOR TUMORS OF THE CENTRAL NERVOUS SYSTEM MERRITT JAMES (US) 2017-04-27 WO disclosed
US-20170112831-A1 USE OF CCR1 ANTAGONISTS AS A TREATMENT FOR TUMORS OF THE CENTRAL NERVOUS SYSTEM MERRITT JAMES (US) 2017-04-27 US disclosed
US-20170112831-A1 USE OF CCR1 ANTAGONISTS AS A TREATMENT FOR TUMORS OF THE CENTRAL NERVOUS SYSTEM MERRITT JAMES (US) 2017-04-27 US disclosed
US-8940800-B2 Pharmaceutical compositions with enhanced performance BEND RESEARCH, INC. (US) 2015-01-27 US disclosed
US-8940800-B2 Pharmaceutical compositions with enhanced performance BEND RESEARCH, INC. (US) 2015-01-27 US disclosed
US-8772298-B2 Spirocyclic heterocycles medicaments containing said compounds, use thereof and method for their production BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-07-08 US disclosed
US-20110046148-A1 Spirocyclic Heterocycles Medicaments Containing Said Compounds, Use Thereof And Method For Their Production BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-02-24 US disclosed
US-7887840-B2 Bioavailability of low- solubility drugs BEND RESEARCH, INC. (US) 2011-02-15 US disclosed
EP-2275091-A1 Pharmaceutical compositions comprising adsorbates of an amorphous drug Pfizer Products Inc. (US) 2011-01-19 EP disclosed
EP-2245026-A1 SPIROCYCLIC HETEROCYCLES, MEDICAMENTS CONTAINING SAID COMPOUNDS, USE THEREOF AND METHOD FOR THEIR PRODUCTION Boehringer Ingelheim International GmbH (DE) 2010-11-03 EP disclosed
EP-1530457-B1 PHARMACEUTICAL COMPOSITIONS OF DRUGS IN SEMI-ORDERED FORM AND POLYMERS BEND RES INC (US) 2009-09-09 EP disclosed
WO-2009098061-A1 SPIROCYCLIC HETEROCYCLES, MEDICAMENTS CONTAINING SAID COMPOUNDS, USE THEREOF AND METHOD FOR THEIR PRODUCTION BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-08-13 WO disclosed
US-20080262107-A1 A solid amorphous dispersion of a low-soluble drug and hydroxypropylmethyl celllulose acetate succinate with an ester degree of substitution of 0.85 which results in concentration-enhancement, time release agents, and storage stability; rapid crystal growth inhibitors in supersaturated aqueous solutions PFIZER PRODUCTS INC. (US) 2008-10-23 US disclosed
US-20080262107-A1 A solid amorphous dispersion of a low-soluble drug and hydroxypropylmethyl celllulose acetate succinate with an ester degree of substitution of 0.85 which results in concentration-enhancement, time release agents, and storage stability; rapid crystal growth inhibitors in supersaturated aqueous solutions PFIZER PRODUCTS INC. (US) 2008-10-23 US disclosed
US-20060003011-A1 Pharmaceutical compositions of drugs and neutralized acidic polymers PFIZER INC 2006-01-05 US disclosed
WO-2004014342-A1 PHARMACEUTICAL COMPOSITIONS OF SEMI-ORDERED DRUGS AND POLYMERS PFIZER PRODUCTS INC. (US) 2004-02-19 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 (4 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-20110046148-A1 Spirocyclic Heterocycles Medicaments Containing Said Compounds, Use Thereof And Method For Their Production PKD1, BPHL, CYP11B2 CCR1 3581/4885CHRM2 2022/4885CCR5 3069/4885
US-20170112831-A1 USE OF CCR1 ANTAGONISTS AS A TREATMENT FOR TUMORS OF THE CENTRAL NERVOUS SYSTEM CCR1, CCR3, CCR4 CCR1 1/4885CHRM2 1661/4885CCR5 11/4885
US-20080262107-A1 A solid amorphous dispersion of a low-soluble drug and hydroxypropylmethyl celllulose acetate succinate with an ester degree of substitution of 0.85 which results in concentration-enhancement, time release agents, and storage stability; rapid crystal growth inhibitors in supersaturated aqueous solutions HPD, HAAO, SUCLA2 CCR1 3742/4885CHRM2 2101/4885CCR5 4603/4885
US-20060003011-A1 Pharmaceutical compositions of drugs and neutralized acidic polymers PDE7A, CA6, PDE9A CCR1 1188/4885CHRM2 2122/4885CCR5 975/4885

“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.