SCHEMBL803462

SCHEMBL803462

CC(C)(C)CC1CCN(Cc2ccccc2)CC1

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 1/20 0.67
ACHE P22303 6/20 0.64
ALDH1A1 P00352 1/20 0.58
CXCR4 P61073 1/20 0.58
SIGMAR1 Q99720 1/20 0.57
BCHE P06276 2/20 0.56
DRD2 P14416 1/20 0.54
DRD4 P21917 1/20 0.54
DRD3 P35462 1/20 0.54

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
SCHEMBL803083 0.90 CCR3 (0.58) CCR3ACHEALDH1A1CXCR4BCHE
SCHEMBL3307904 0.89 CCR3 (0.61) CCR3ACHEALDH1A1CXCR4SIGMAR1
SCHEMBL8907111 0.87 CCR3 (0.63) CCR3ACHEALDH1A1CXCR4BCHE
SCHEMBL6749556 0.86 CCR3 (0.58) CCR3ACHEALDH1A1CXCR4BCHE
SCHEMBL20314493 0.85 HRH3 (0.49) CCR3ACHEALDH1A1CXCR4
SCHEMBL15140944 0.84 CCR3 (0.73) CCR3ACHEALDH1A1CXCR4SIGMAR1
SCHEMBL13003723 0.84 CCR3 (0.55) CCR3ACHEALDH1A1CXCR4BCHE
SCHEMBL803087 0.83 ACHE (0.49) CCR3ACHEALDH1A1SIGMAR1
SCHEMBL69200 0.83 CCR3 (0.67) CCR3ACHEALDH1A1CXCR4BCHE
SCHEMBL6749208 0.82 CCR3 (0.54) CCR3ACHEALDH1A1CXCR4BCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10954229-B2 GPR119 agonist compounds MANKIND PHARMA LTD. (IN) 2021-03-23 US disclosed
US-20200317661-A1 NOVEL GPR119 AGONIST COMPOUNDS MANKIND PHARMA LTD. (IN) 2020-10-08 US disclosed
US-10752622-B2 GPR119 agonist compounds MANKIND PHARMA LTD. (IN) 2020-08-25 US disclosed
US-20190127363-A1 NOVEL GPR119 AGONIST COMPOUNDS MANKIND PHARMA LTD. (IN) 2019-05-02 US disclosed
US-20170291894-A1 NOVEL GPR119 AGONIST COMPOUNDS MANKIND PHARMA LTD. (IN) 2017-10-12 US disclosed
US-20170014419-A1 MEDICAMENT FOR SUPPRESSING MALIGNANT TUMOR METASTASIS NATIONAL CEREBRAL AND CARDIOVASCULAR CENTER (JP) 2017-01-19 US disclosed
US-20170014419-A1 MEDICAMENT FOR SUPPRESSING MALIGNANT TUMOR METASTASIS NATIONAL CEREBRAL AND CARDIOVASCULAR CENTER (JP) 2017-01-19 US disclosed
US-8962642-B2 5-cyano-4- (pyrrolo [2,3B] pyridine-3-yl) -pyrimidine derivatives useful as protein kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2015-02-24 US disclosed
US-8680159-B2 Bradykinin 1 receptor modulating compounds GRUENENTHAL GMBH (DE) 2014-03-25 US disclosed
US-20140056847-A1 INHIBITORS OF SERINE PROTEASES VERTEX PHARMACEUTICALS INCORPORATED (US) 2014-02-27 US disclosed
US-8247421-B2 5-cyano-4-(pyrrolo [2,3B] pyridine-3-yl)-pyrimidine derivatives useful as protein kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-08-21 US disclosed
US-20120071461-A1 Substituted Benzamide Compounds GRUENENTHAL GMBH (DE) 2012-03-22 US disclosed
US-20110171175-A1 INHIBITORS OF SERINE PROTEASES VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-07-14 US disclosed
US-20110171175-A1 INHIBITORS OF SERINE PROTEASES VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-07-14 US disclosed
US-20100228026-A1 NOVEL MALONIC ACID SULFONAMIDE DERIVATIVE AND PHARMACEUTICAL USE THEREOF MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-09-09 US disclosed
US-20100189773-A1 5-CYANO-4- (PYRROLO [2,3] PYRIDINE-3-YL) -PYRIMIDINE DERIVATIVES USEFUL AS PROTEIN KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED 2010-07-29 US disclosed
US-20100168114-A1 INVERTEBRATE ACETYLCHOLINESTERASE INHIBITORS MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH 2010-07-01 US disclosed
US-20100168114-A1 INVERTEBRATE ACETYLCHOLINESTERASE INHIBITORS MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH 2010-07-01 US disclosed
US-20080312091-A1 INVERTEBRATE ACETYLCHOLINESTERASE INHIBITORS MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH 2008-12-18 US disclosed
US-20070105781-A1 Inhibitors of serine proteases VERTEX PHARMACEUTICALS INCORPORATED 2007-05-10 US 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 (13 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-20110171175-A1 INHIBITORS OF SERINE PROTEASES PRSS1, SERPINB1, PRSS3 CCR3 845/4885ACHE 1731/4885ALDH1A1 1984/4885
US-20140056847-A1 INHIBITORS OF SERINE PROTEASES PRSS1, SERPINB1, PRSS3 CCR3 845/4885ACHE 1731/4885ALDH1A1 1984/4885
US-20100168114-A1 INVERTEBRATE ACETYLCHOLINESTERASE INHIBITORS ACHE, BCHE, CHAT CCR3 4292/4885ACHE 1/4885ALDH1A1 596/4885
US-20200317661-A1 NOVEL GPR119 AGONIST COMPOUNDS GPR119, GPR84, GPR88 CCR3 1016/4885ACHE 3961/4885ALDH1A1 1629/4885
US-20100189773-A1 5-CYANO-4- (PYRROLO [2,3] PYRIDINE-3-YL) -PYRIMIDINE DERIVATIVES USEFUL AS PROTEIN KINASE INHIBITORS MAP3K5, CDK5, MAP3K20 CCR3 2340/4885ACHE 3014/4885ALDH1A1 4040/4885
US-20070105781-A1 Inhibitors of serine proteases PRSS1, SERPINB1, PRSS3 CCR3 857/4885ACHE 1686/4885ALDH1A1 2154/4885
US-20170291894-A1 NOVEL GPR119 AGONIST COMPOUNDS GPR119, GPR84, GPR88 CCR3 1016/4885ACHE 3961/4885ALDH1A1 1629/4885
US-10752622-B2 GPR119 agonist compounds GPR119, GPR84, GPR65 CCR3 987/4885ACHE 3907/4885ALDH1A1 1844/4885
US-20100228026-A1 NOVEL MALONIC ACID SULFONAMIDE DERIVATIVE AND PHARMACEUTICAL USE THEREOF REN, AGTR2, AGTR1 CCR3 3327/4885ACHE 2298/4885ALDH1A1 617/4885
US-20170014419-A1 MEDICAMENT FOR SUPPRESSING MALIGNANT TUMOR METASTASIS AGTR2, MME, AGTR1 CCR3 4152/4885ACHE 3243/4885ALDH1A1 2036/4885
US-10954229-B2 GPR119 agonist compounds GPR119, GPR84, GPR65 CCR3 987/4885ACHE 3907/4885ALDH1A1 1844/4885
US-20190127363-A1 NOVEL GPR119 AGONIST COMPOUNDS GPR119, GPR84, GPR88 CCR3 1016/4885ACHE 3961/4885ALDH1A1 1629/4885
US-20120071461-A1 Substituted Benzamide Compounds BDKRB1, BDKRB2, HRH2 CCR3 517/4885ACHE 746/4885ALDH1A1 1267/4885

“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.