SCHEMBL4904722

SCHEMBL4904722

C=CCCCC(C)(CCCC=C)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.45
ABCC4 O15439 1/20 0.45
TSHR P16473 5/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C19 P33261 1/20 0.41
HIF1A Q16665 1/20 0.41
ACLY P53396 1/20 0.41
ALDH1A1 P00352 6/20 0.39
LMNA P02545 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.34
FFAR1 O14842 1/20 0.32
CPT2 P23786 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
USP2 O75604 2/20 0.32
CYP3A4 P08684 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
RECQL P46063 1/20 0.32
ACACB O00763 1/20 0.31
ACACA Q13085 1/20 0.31
LPAR2 Q9HBW0 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
SCHEMBL9655594 0.90 ABCC4 (0.41) MAPTABCC4TSHRCYP2D6CYP2C19
SCHEMBL22367729 0.86 ACLY (0.43) MAPTABCC4TSHRCYP2D6CYP2C19
SCHEMBL10652723 0.86 TSHR (0.41) MAPTABCC4TSHRCYP2D6CYP2C19
SCHEMBL20140467 0.86 ACLY (0.43) MAPTABCC4TSHRCYP2D6CYP2C19
SCHEMBL17950998 0.86 MAPT (0.67) MAPTABCC4CYP2D6CYP2C19ACLY
SCHEMBL6067673 0.82 MAPT (0.45) MAPTABCC4TSHRCYP2D6CYP2C19
SCHEMBL2894770 0.82 ACLY (0.61) MAPTABCC4TSHRACLYALDH1A1
SCHEMBL10207253 0.78 TSHR (0.38) MAPTABCC4TSHRCYP2D6CYP2C19
SCHEMBL1975627 0.78 ARG1 (0.53) MAPTABCC4TSHRCYP2C19ACLY
SCHEMBL1977004 0.78 ARG1 (0.53) MAPTABCC4TSHRCYP2C19ACLY

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11834482-B2 Agents modulating beta-catenin functions and methods thereof FOG PHARMACEUTICALS, INC. (US) 2023-12-05 US disclosed
US-20230357320-A1 HELICAL STAPLED PEPTIDES AND USES THEREOF PARABILIS MEDICINES, INC. 2023-11-09 US disclosed
US-9556227-B2 Stitched polypeptides PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2017-01-31 US disclosed
EP-1446437-B1 COMPOUNDS CONTAINING QUATERNARY CARBONS, MEDICAL DEVICES, AND METHODS MEDTRONIC INC (US) 2015-04-15 EP disclosed
US-20140011979-A1 STITCHED POLYPEPTIDES PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2014-01-09 US disclosed
US-20100184645-A1 STITCHED POLYPEPTIDES PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2010-07-22 US disclosed
US-20080064845-A9 Compounds containing quaternary carbons, medical devices, and methods MEDTRONIC, INC. (US) 2008-03-13 US disclosed
US-20060252905-A1 Compounds containing quaternary carbons, medical devices, and methods MEDTRONIC, INC. (US) 2006-11-09 US disclosed
US-7101956-B2 Compounds containing quaternary carbons, medical devices, and methods MEDTRONIC, INC. (US) 2006-09-05 US disclosed
EP-1446437-A1 COMPOUNDS CONTAINING QUATERNARY CARBONS, MEDICAL DEVICES, AND METHODS Medtronic, Inc. (US) 2004-08-18 EP disclosed
US-20030125499-A1 Compounds containing quaternary carbons, medical devices, and methods MEDTRONIC, INC. 2003-07-03 US disclosed
WO-2003042273-A1 COMPOUNDS CONTAINING QUATERNARY CARBONS, MEDICAL DEVICES, AND METHODS MEDTRONIC, INC. (US) 2003-05-22 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 (4 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-20230357320-A1 HELICAL STAPLED PEPTIDES AND USES THEREOF ESRRB, ESR1, ESRRA MAPT 2983/4885ABCC4 4741/4885TSHR 671/4885
US-20100184645-A1 STITCHED POLYPEPTIDES VIP, IAPP, NGLY1 MAPT 2152/4885ABCC4 3682/4885TSHR 2524/4885
US-20140011979-A1 STITCHED POLYPEPTIDES VIP, IAPP, NGLY1 MAPT 2152/4885ABCC4 3682/4885TSHR 2524/4885
US-11834482-B2 Agents modulating beta-catenin functions and methods thereof CTNNB1, CTNNBL1, CTNNA1 MAPT 3674/4885ABCC4 4161/4885TSHR 4346/4885

“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.