SCHEMBL504434

SCHEMBL504434

Brc1cc2cccnc2c2ncccc12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 5/20 0.61
CCR8 P51685 5/20 0.61
L3MBTL1 Q9Y468 4/20 0.61
HSP90AA1 P07900 3/20 0.59
TDP1 Q9NUW8 3/20 0.59
HTT P42858 3/20 0.59
SMN1; SMN2 Q16637 3/20 0.59
KDM4E B2RXH2 2/20 0.59
TP53 P04637 2/20 0.59
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
USP2 O75604 1/20 0.59
MAPT P10636 3/20 0.58
CCR5 P51681 3/20 0.58
LMNA P02545 3/20 0.58
MMP2 P08253 2/20 0.58
TSHR P16473 2/20 0.58
GMNN O75496 1/20 0.58
CYP3A4 P08684 1/20 0.58
CYP2D6 P10635 1/20 0.58

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
Water SCHEMBL28360091 0.98 CCR1 (0.59) CCR1CCR8L3MBTL1HSP90AA1TDP1
SCHEMBL17965489 0.98 CCR1 (0.59) CCR1CCR8L3MBTL1HSP90AA1TDP1
SCHEMBL3053868 0.88 MAPT (0.63) CCR1CCR8L3MBTL1HSP90AA1TDP1
SCHEMBL22117517 0.86 KDM4E (0.58) CCR1CCR8L3MBTL1HSP90AA1TDP1
SCHEMBL29720452 0.86 ALDH1A1 (0.62) CCR1CCR8L3MBTL1HSP90AA1TDP1
SCHEMBL16546999 0.86 ALDH1A1 (0.62) CCR1CCR8L3MBTL1HSP90AA1TDP1
SCHEMBL29234946 0.84 HTT (0.51) CCR1CCR8L3MBTL1HSP90AA1TDP1
SCHEMBL17174186 0.83 CCR1 (0.45) CCR1CCR8L3MBTL1HSP90AA1TDP1
SCHEMBL10506533 0.82 CCR1 (0.62) CCR1CCR8L3MBTL1HSP90AA1TDP1
SCHEMBL29650434 0.82 CCR1 (0.62) CCR1CCR8L3MBTL1HSP90AA1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119751437-A Synthesis method of Se-deuterated methyl-thioridazine compound 浙江工业大学 2025-04-04 CN claimed
CN-118619974-A Synthesis method of asymmetric 1, 10-phenanthroline compound for OLED (organic light emitting diode) material 大连理工大学 2024-09-10 CN claimed
CN-116462695-A Rhodamine B Schiff base aluminum complex, preparation method thereof and application thereof in detection of trace water in alcohol solvent 武汉工程大学 2023-07-21 CN claimed
US-20230167144-A1 PREPARATION AND ITS APPLICATION OF A CYANIDE-BRIDGED METAL ORGANIC COMPOUND WITH INTRAMOLECULAR MAGNETIC TRANSFORMATION Hubei Jingmen Industrial Technology Research Institute Co., Ltd. (CN) 2023-06-01 US claimed
CN-111718381-A Osmium metal organic compound containing polypyridine ligand and preparation method and application thereof 荆楚理工学院 2020-09-29 CN claimed
CN-111518145-A Cyanide-bridged metal organic compound with intramolecular magnetic transformation, and preparation method and application thereof 荆楚理工学院 2020-08-11 CN claimed
US-10247712-B2 Printable oxygen sensing composition SUN CHEMICAL B.V. (NL) 2019-04-02 US claimed
US-20170016865-A1 PRINTABLE OXYGEN SENSING COMPOSITION SUN CHEMICAL B.V. (NL) 2017-01-19 US claimed
US-9459241-B2 Printable oxygen sensing composition SUN CHEMICAL B.V. (NL) 2016-10-04 US claimed
EP-2195649-B1 Printable oxygen sensing composition and a substrate or pouch coated with the composition SUN CHEMICAL BV (NL) 2015-11-18 EP claimed
US-5632958-A Indicator containing perfluorinated polyurethane membranes for use in optical oxygen sensors OPTICAL SENSORS INCORPORATED (US) 1997-05-27 US claimed
WO-1997009609-A1 METHOD FOR MANUFACTURING FIBER OPTIC SENSORS AND NOVEL SENSORS PROVIDED THEREBY OPTICAL SENSORS INCORPORATED (US) 1997-03-13 WO claimed
EP-0746757-A1 A RATIOMETRIC FLUORESCENCE METHOD TO MEASURE OXYGEN OPTICAL SENSORS INCORPORATED (US) 1996-12-11 EP claimed
CN-1130943-A Ratiometric fluorescence method to measure oxygen OPTICAL SENSORS INC (US) 1996-09-11 CN claimed
EP-0630469-A4 CROSSLINKED GAS-PERMEABLE MEMBRANE OF A CURED PERFLUORINATED URETHANE POLYMER, AND OPTICAL GAS SENSORS FABRICATED THEREWITH. OPTICAL SENSORS INC (US) 1995-11-22 EP claimed
US-5462880-A Fluorinated polyurethane as permeable membrane OPTICAL SENSORS INCORPORATED (US) 1995-10-31 US claimed
US-5453248-A Cross-linked gas permeable membrane of a cured perfluorinated urethane polymer, and optical gas sensors fabricated therewith OPTICAL SENSORS INCORPORATED (US) 1995-09-26 US claimed
WO-1995008107-A1 A RATIOMETRIC FLUORESCENCE METHOD TO MEASURE OXYGEN OPTICAL SENSORS INCORPORATED (US) 1995-03-23 WO claimed
EP-0630469-A1 CROSSLINKED GAS-PERMEABLE MEMBRANE OF A CURED PERFLUORINATED URETHANE POLYMER, AND OPTICAL GAS SENSORS FABRICATED THEREWITH OPTICAL SENSORS INCORPORATED (US) 1994-12-28 EP claimed
WO-1993018391-A1 CROSSLINKED GAS-PERMEABLE MEMBRANE OF A CURED PERFLUORINATED URETHANE POLYMER, AND OPTICAL GAS SENSORS FABRICATED THEREWITH OPTICAL SENSORS INCORPORATED (US) 1993-09-16 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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-20170016865-A1 PRINTABLE OXYGEN SENSING COMPOSITION COXFA4L2, PPOX, PDE6B CCR1 4376/4885CCR8 4606/4885L3MBTL1 2182/4885
US-10247712-B2 Printable oxygen sensing composition COXFA4L2, PPOX, PDE6B CCR1 4376/4885CCR8 4606/4885L3MBTL1 2182/4885

“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.