SCHEMBL1106410

SCHEMBL1106410

CC(C)C(=N)N1CCCC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 1/20 0.42
▸ ALDH1A1 P00352 4/20 0.33
▸ MAPT P10636 2/20 0.33
▸ HPGD P15428 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ ALOX12 P18054 1/20 0.33
▸ NFKB1 P19838 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ THPO P40225 1/20 0.33
▸ MTOR P42345 1/20 0.33
▸ NFKB2 Q00653 1/20 0.33
▸ RELA Q04206 1/20 0.33
▸ HIF1A Q16665 1/20 0.33

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
SCHEMBL1106418 0.97 F2 (0.46) F2ALDH1A1MAPTHPGDKDM4E
Hydrochloric Acid SCHEMBL17472551 0.97 F2 (0.40) F2ALDH1A1MAPTHPGDKDM4E
Hydrochloric Acid SCHEMBL28628605 0.97 F2 (0.40) F2ALDH1A1MAPTHPGDKDM4E
Hydrochloric Acid SCHEMBL28661283 0.95 F2 (0.39) F2ALDH1A1MAPTHPGDKDM4E
SCHEMBL1106404 0.94 — —
SCHEMBL16477891 0.88 — —
SCHEMBL1106399 0.79 CYP1A2 (0.42) ALDH1A1KDM4ECYP1A2CYP2C19HSD17B10
SCHEMBL1106416 0.77 SMN1; SMN2 (0.44) ALDH1A1MAPTHPGDTP53CYP3A4
SCHEMBL1106406 0.77 CA2 (0.38) HPGDCYP1A2CA12CA1CA2
SCHEMBL10281997 0.75 ALDH1A1 (0.48) ALDH1A1MAPTHPGDTP53CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118159576-A Copolymer emulsion, and one-part thermosetting resin composition, two-part thermosetting resin composition, paint, resin cured film, and coating film using the copolymer emulsion 株式会社力森诺科 2024-06-07 — — CN disclosed
CN-114026138-B Acrylic rubber having excellent storage stability 日本瑞翁株式会社 2024-03-19 — — CN disclosed
CN-114051505-B Acrylic rubber bag excellent in storage stability and processability 日本瑞翁株式会社 2024-03-08 — — CN disclosed
CN-114127137-B Acrylic rubber bag excellent in strength characteristics and workability 日本瑞翁株式会社 2024-03-01 — — CN disclosed
CN-114080402-B Acrylic rubber having excellent water resistance 日本瑞翁株式会社 2024-02-27 — — CN disclosed
CN-114051506-B Acrylic rubber bag excellent in storage stability and water resistance 日本瑞翁株式会社 2024-02-20 — — CN disclosed
CN-114026137-B Acrylic rubber having excellent water resistance 日本瑞翁株式会社 2023-12-29 — — CN disclosed
CN-117222678-A Crosslinkable acrylic copolymer, composition containing acrylic copolymer and rubber material 株式会社大阪曹达 2023-12-12 — — CN disclosed
CN-114080422-B Acrylic rubber sheet with excellent water resistance 日本瑞翁株式会社 2023-11-24 — — CN disclosed
CN-117043207-A Acrylic copolymer, composition containing acrylic copolymer, and acrylic copolymer crosslinked product 株式会社大阪曹达 2023-11-10 — — CN disclosed
US-20100234352-A1 FACTOR XA INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. 2010-09-16 — — US disclosed
US-7696352-B2 Factor Xa inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2010-04-13 — — US disclosed
US-7678913-B2 Ureas as factor Xa inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2010-03-16 — — US disclosed
CN-100572470-C Film, water-based coating material and use its method of forming coating film and the formation painting object of filming MITSUBISHI RAYON CO (JP) 2009-12-23 — — CN disclosed
US-20090298806-A1 FACTOR XA INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. 2009-12-03 — — US disclosed
US-20090298806-A1 FACTOR XA INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. 2009-12-03 — — US disclosed
US-7521470-B2 Factor Xa inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2009-04-21 — — US disclosed
US-20070185092-A1 FACTOR Xa INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2007-08-09 — — US disclosed
CN-1926208-A Coating, water coating material and process for producing the same and coated article furnished with the coating MITSUBISHI RAYON CO (JP) 2007-03-07 — — CN disclosed
WO-2006002099-A2 FACTOR XA INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2006-01-05 — — 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 (3 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-20070185092-A1 FACTOR Xa INHIBITORS TFPI, F12, F11 F2 5/4885ALDH1A1 1402/4885MAPT 4564/4885
US-20090298806-A1 FACTOR XA INHIBITORS TFPI, F12, F11 F2 5/4885ALDH1A1 974/4885MAPT 3722/4885
US-20100234352-A1 FACTOR XA INHIBITORS TFPI, F12, F11 F2 5/4885ALDH1A1 1402/4885MAPT 4564/4885

“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.

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