SCHEMBL5301328

SCHEMBL5301328

OCc1ccc2ccc3ccc(CO)nc3c2n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 5/20 1.00
CCR5 P51681 2/20 0.38
RAB9A P51151 1/20 0.38
PARP1 P09874 1/20 0.36
S1PR4 O95977 2/20 0.34
PDE10A Q9Y233 1/20 0.33
NOTUM Q6P988 1/20 0.32
KDM4E B2RXH2 1/20 0.31
GMNN O75496 1/20 0.31
LMNA P02545 1/20 0.31
TP53 P04637 1/20 0.31
HSP90AA1 P07900 1/20 0.31
MMP2 P08253 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
MAPT P10636 1/20 0.31
MMP9 P14780 1/20 0.31
ALOX15 P16050 1/20 0.31
TSHR P16473 1/20 0.31
NFKB1 P19838 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
SCHEMBL7555954 0.83 CCR1 (0.69) CCR1CCR5PARP1PDE10AKDM4E
SCHEMBL9220073 0.80 CCR1 (0.65) CCR1RAB9APDE10AKDM4ELMNA
SCHEMBL14478402 0.79 CCR1 (0.63) CCR1RAB9AKDM4ELMNAHTT
SCHEMBL7806536 0.79 CCR1 (0.63) CCR1RAB9APARP1PDE10ANOTUM
SCHEMBL8588461 0.79 CCR1 (0.63) CCR1PARP1PDE10AKDM4ECYP3A4
SCHEMBL1498632 0.75 CCR1 (0.59) CCR1CCR5PARP1KDM4ELMNA
SCHEMBL3277356 0.74 PDE10A (0.61) CCR1PDE10A
SCHEMBL17436930 0.73 CCR1 (0.55) CCR1
SCHEMBL15581732 0.72 CCR1 (0.56) CCR1CCR5RAB9APARP1PDE10A
SCHEMBL31648790 0.72 CCR1 (0.56) CCR1CCR5RAB9APARP1PDE10A

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
CN-103242827-B Florescent ion probe reagent for zinc ion detection and preparation method thereof UNIV NANKAI 2014-08-06 CN claimed
US-7238832-B2 Production method of a coupling compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-07-03 US claimed
EP-1449580-B1 Production method of a cross-coupling compound from an alkyl halide and an organoboron compound SUMITOMO CHEMICAL CO (JP) 2005-12-28 EP claimed
US-20040167364-A1 Production method of a coupling compound SUMITOMO CHEMICAL COMPANY, LIMITED 2004-08-26 US claimed
EP-1449580-A1 Production method of a cross-coupling compound from an alkyl halide and an organoboron compound Sumitomo Chemical Co.,Ltd. (JP) 2004-08-25 EP claimed
CN-119118821-A Rare earth carboxylic acid complex, preparation method and application thereof 包头稀土研究院 2024-12-13 CN disclosed
CN-113201335-B Enhanced fluorescent carbon dot, preparation method and application in cadmium ion detection 江南大学 2022-07-05 CN disclosed
CN-113201335-A Enhanced fluorescent carbon dot, preparation method and application in cadmium ion detection 江南大学 2021-08-03 CN disclosed
WO-2019243546-A1 COATING COMPOSITION PPG EUROPE B.V. (NL) 2019-12-26 WO disclosed
CN-103242827-B Florescent ion probe reagent for zinc ion detection and preparation method thereof UNIV NANKAI 2014-08-06 CN disclosed
CN-103242827-B Florescent ion probe reagent for zinc ion detection and preparation method thereof UNIV NANKAI 2014-08-06 CN disclosed
CN-103242827-A Florescent ion probe reagent for zinc ion detection and preparation method thereof UNIV NANKAI 2013-08-14 CN disclosed
EP-1242824-A2 SCREENING USING BIOLOGICAL TARGET MOLECULES WITH METAL-ION BINDING SITES 7TM Pharma (DK) 2002-09-25 EP disclosed
WO-2001050127-A9 SCREENING USING BIOLOGICAL TARGET MOLECULES WITH METAL-ION BINDING SITES 7TM PHARMA (DK) 2002-09-12 WO disclosed
US-20020061599-A1 Method of identifying ligands of biological target molecules 7TM PHARMA (DK) 2002-05-23 US disclosed
WO-2001050127-A2 SCREENING USING BIOLOGICAL TARGET MOLECULES WITH METAL-ION BINDING SITES 7TM PHARMA (DK) 2001-07-12 WO disclosed
US-5637311-A ANTIVIRAL AGENTS AND/OR ANTIINFLAMMATORY AGENTS PROCYTE CORPORATION (US) 1997-06-10 US disclosed
US-4859777-A Terpyridine chelating agents EASTMAN KODAK COMPANY (US) 1989-08-22 US disclosed
US-4837169-A RADIOIMMUNOASSAY EASTMAN KODAK COMPANY (US) 1989-06-06 US disclosed
EP-0288256-A2 Fluorescent labels EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1988-10-26 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 (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-20040167364-A1 Production method of a coupling compound PYM1, BRIX1, CXCR1 CCR1 94/4885CCR5 973/4885RAB9A 2408/4885

“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.