SCHEMBL5066976

SCHEMBL5066976

C=CCCCCCCC(N)=O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.67
ABCC4 O15439 1/20 0.67
ALDH1A1 P00352 2/20 0.63
LMNA P02545 2/20 0.57
CYP3A4 P08684 3/20 0.54
FAAH O00519 3/20 0.54
SOAT1 P35610 2/20 0.54
MEN1 O00255 1/20 0.54
TP53 P04637 1/20 0.54
CYP1A2 P05177 1/20 0.54
CYP2C19 P33261 1/20 0.54
KMT2A Q03164 1/20 0.54
KDM4E B2RXH2 2/20 0.48
TSHR P16473 2/20 0.44
LPAR3 Q9UBY5 2/20 0.42
LPAR2 Q9HBW0 1/20 0.42
CNR1 P21554 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
USP2 O75604 1/20 0.41
RECQL P46063 1/20 0.41

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
SCHEMBL3982551 1.00 MAPT (0.67) MAPTABCC4ALDH1A1LMNACYP3A4
SCHEMBL10548401 1.00 MAPT (0.67) MAPTABCC4ALDH1A1LMNACYP3A4
SCHEMBL9299029 1.00 MAPT (0.67) MAPTABCC4ALDH1A1LMNACYP3A4
SCHEMBL24287565 1.00 MAPT (0.67) MAPTABCC4ALDH1A1LMNACYP3A4
SCHEMBL9856658 1.00 MAPT (0.67) MAPTABCC4ALDH1A1LMNACYP3A4
SCHEMBL25269893 1.00 MAPT (0.67) MAPTABCC4ALDH1A1LMNACYP3A4
SCHEMBL3119162 1.00 MAPT (0.67) MAPTABCC4ALDH1A1LMNACYP3A4
SCHEMBL16758454 1.00 MAPT (0.67) MAPTABCC4ALDH1A1LMNACYP3A4
SCHEMBL3127526 1.00 MAPT (0.67) MAPTABCC4ALDH1A1LMNACYP3A4
SCHEMBL454519 1.00 MAPT (0.67) MAPTABCC4ALDH1A1LMNACYP3A4

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114025751-A Compositions and methods for treating hepatitis b virus infection 安徽荣航生物科技发展有限责任公司 2022-02-08 CN claimed
CN-100551902-C light active material ROLIC AG (CH) 2009-10-21 CN claimed
CN-1671648-A photoactive material ROLIC AG (CH) 2005-09-21 CN claimed
CN-116650397-A Colchicine cream and preparation method thereof 山东新时代药业有限公司 2023-08-29 CN disclosed
WO-2023087632-A1 ANTI-INFLAMMATORY ANALGESIC COMPOUND AND USE THEREOF 江苏新元素医药科技有限公司 2023-05-25 WO disclosed
CN-114828840-A Improved topical compositions of colchicine 泽威恩制药有限责任公司 2022-07-29 CN disclosed
CN-114656429-A Anti-inflammatory analgesic compound and application thereof 江苏新元素医药科技有限公司 2022-06-24 CN disclosed
CN-114025751-A Compositions and methods for treating hepatitis b virus infection 安徽荣航生物科技发展有限责任公司 2022-02-08 CN disclosed
EP-3461835-A1 CYCLOSPORINE ANALOGUE MOLECULES MODIFIED AT AMINO ACID 1 AND 3 ContraVir Pharmaceuticals, Inc. (US) 2019-04-03 EP disclosed
US-8481558-B2 Compounds to inhibit or augment an inflammatory response CAMBRIDGE ENTERPRISE LIMITED (GB) 2013-07-09 US disclosed
EP-2331552-B1 HEPATITIS C VIRUS INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2013-02-27 EP disclosed
US-20080045557-A1 Administering chemokine peptides, variants, and derivatives thereof, as well as chemokine peptide analogs to modulate the migration or recruitment of leukocytes to a preselected physiological site CAMBRIDGE UNIVERSITY TECHNICAL SERVICES LTD. 2008-02-21 US disclosed
US-7238711-B1 Compounds and methods to inhibit or augment an inflammatory response CAMBRIDGE UNIVERSITY TECHNICAL SERVICES LTD. (GB) 2007-07-03 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 (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-20080045557-A1 Administering chemokine peptides, variants, and derivatives thereof, as well as chemokine peptide analogs to modulate the migration or recruitment of leukocytes to a preselected physiological site CCL2, CCL11, CCL5 MAPT 4750/4885ABCC4 2633/4885ALDH1A1 4774/4885

“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.