SCHEMBL289107

SCHEMBL289107

C=C[CH]CC(=O)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 1/20 0.54
MAPT P10636 4/20 0.52
MAPK1 P28482 3/20 0.52
TDP1 Q9NUW8 3/20 0.52
KMT2A Q03164 3/20 0.52
MEN1 O00255 2/20 0.52
CYP3A4 P08684 2/20 0.52
HPGD P15428 2/20 0.52
CES1 P23141 2/20 0.52
KDM4E B2RXH2 1/20 0.52
ALOX15 P16050 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
ALDH1A1 P00352 6/20 0.48
GSK3B P49841 2/20 0.48
PTPN1 P18031 2/20 0.48
HIF1A Q16665 2/20 0.48
TRPA1 O75762 1/20 0.48
L3MBTL1 Q9Y468 2/20 0.47
LMNA P02545 2/20 0.47
NR4A2 P43354 1/20 0.47

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
SCHEMBL367640 0.83 AKT1 (0.58) AKT1MAPTMAPK1TDP1KMT2A
SCHEMBL8189830 0.81 AKT1 (0.56) AKT1MAPTMAPK1TDP1KMT2A
SCHEMBL28264973 0.78 MAPK1 (0.56) AKT1MAPTMAPK1TDP1KMT2A
SCHEMBL11070858 0.78 TDP1 (0.61) AKT1MAPTMAPK1TDP1KMT2A
Benzophenone SCHEMBL18171700 0.78 ALDH1A1 (0.56) AKT1MAPTMAPK1TDP1KMT2A
SCHEMBL305090 0.76 MAPK1 (0.58) AKT1MAPTMAPK1TDP1KMT2A
SCHEMBL8755824 0.75 HPGD (0.64) AKT1MAPTMAPK1TDP1KMT2A
Oxirane SCHEMBL27647497 0.75 AKT1 (0.48) AKT1MAPTMAPK1TDP1KMT2A
SCHEMBL6304856 0.74 MAPK1 (0.56) AKT1MAPTMAPK1TDP1KMT2A
SCHEMBL10414732 0.74 MAPK1 (0.56) AKT1MAPTMAPK1TDP1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11753446-B2 Beta-hairpin peptidomimetics POLYPHOR AG (CH) 2023-09-12 US disclosed
EP-4214220-A1 ANTIMICROBIAL PEPTIDOMIMETICS Spexis AG (CH) 2023-07-26 EP disclosed
EP-4214221-A1 ANTIMICROBIAL PEPTIDOMIMETICS Spexis AG (CH) 2023-07-26 EP disclosed
EP-3087094-B1 BETA-HAIRPIN PEPTIDOMIMETICS AS SELECTIVE ELASTASE INHIBITORS POLYPHOR AG (CH) 2022-06-01 EP disclosed
EP-3201218-B1 BETA-HAIRPIN PEPTIDOMIMETICS POLYPHOR AG (CH) 2021-11-03 EP disclosed
EP-3087087-B1 BETA-HAIRPIN PEPTIDOMIMETICS AS SELECTIVE ELASTASE INHIBITORS POLYPHOR AG (CH) 2021-07-21 EP disclosed
US-20200231629-A1 BETA-HAIRPIN PEPTIDOMIMETICS POLYPHOR AG (CH) 2020-07-23 US disclosed
US-10370412-B2 Beta-hairpin peptidomimetics POLYPHOR AG (CH) 2019-08-06 US disclosed
EP-2978771-B1 BETA-HAIRPIN PEPTIDOMIMETICS POLYPHOR AG (CH) 2019-07-24 EP disclosed
EP-2427476-B1 BETA-HAIRPIN PEPTIDOMIMETICS HAVING CXCR4 ANTAGONIZING ACTIVITY POLYPHOR AG (CH) 2018-08-08 EP disclosed
US-8716242-B2 β-hairpin peptidomimetics POLYPHOR AG (CH) 2014-05-06 US disclosed
EP-2540736-A2 Template-fixed beta-hairpin peptidomimetics with CXCR4 antagonizing activity Polyphor AG (CH) 2013-01-02 EP disclosed
US-20120283168-A1 TEMPLATE-FIXED PEPTIDOMIMETICS WITH CCR10 ANTAGONISTIC ACTIVITY POLYPHOR AG (CH) 2012-11-08 US disclosed
EP-2427476-A1 BETA-HAIRPIN PEPTIDOMIMETICS HAVING CXCR4 ANTAGONIZING ACTIVITY Polyphor Ag (CH) 2012-03-14 EP disclosed
EP-1879911-B1 DYE CONJUGATES OF TEMPLATE-FIXED PEPTIDOMIMETICS POLYPHOR LTD (CH) 2011-08-17 EP disclosed
US-20110135576-A1 DYE CONJUGATES OF TEMPLATE-FIXED PEPTIDOMIMETICS POLYPHOR LTD. (CH) 2011-06-09 US disclosed
WO-2010127704-A1 BETA-HAIRPIN PEPTIDOMIMETICS HAVING CXCR4 ANTAGONIZING ACTIVITY POLYPHOR AG (CH) 2010-11-11 WO disclosed
WO-2010060479-A1 TEMPLATE-FIXED BETA-HAIRPIN PEPTIDOMIMETICS WITH CXCR4 ANTAGONIZING ACTIVITY POLYPHOR AG (CH) 2010-06-03 WO disclosed
EP-1689863-A1 TEMPLATE FIXED BETA-HAIRPIN LOOP MIMETICS AND THEIR USE IN PHAGE DISPLAY Polyphor Ltd. (CH) 2006-08-16 EP disclosed
WO-2005047503-A1 TEMPLATE FIXED ΒΕΤΑ-HAIRPIN LOOP MIMETICS AND THEIR USE IN PHAGE DISPLAY POLYPHOR LTD. (CH) 2005-05-26 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 (5 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-20200231629-A1 BETA-HAIRPIN PEPTIDOMIMETICS BET1, BACH1, POLL AKT1 2845/4885MAPT 2072/4885MAPK1 2575/4885
US-20120283168-A1 TEMPLATE-FIXED PEPTIDOMIMETICS WITH CCR10 ANTAGONISTIC ACTIVITY CCR10, CCR1, CCRL2 AKT1 4389/4885MAPT 3273/4885MAPK1 1997/4885
US-20110135576-A1 DYE CONJUGATES OF TEMPLATE-FIXED PEPTIDOMIMETICS CXCR4, CXCL12, CXCR1 AKT1 870/4885MAPT 3179/4885MAPK1 3275/4885
US-10370412-B2 Beta-hairpin peptidomimetics POLL, BACE1, C1S AKT1 1789/4885MAPT 1457/4885MAPK1 1501/4885
US-11753446-B2 Beta-hairpin peptidomimetics POLL, BACE1, C1S AKT1 1929/4885MAPT 2235/4885MAPK1 1908/4885

“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.