SCHEMBL21986709

SCHEMBL21986709

Cc1ccc(/C=C/C(N)=O)cc1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PELI1 Q96FA3 1/20 0.53
IAPP P10997 3/20 0.51
PTGS1 P23219 1/20 0.51
TTR P02766 3/20 0.49
MMP1 P03956 3/20 0.49
MMP2 P08253 3/20 0.49
MMP9 P14780 3/20 0.49
KDM4E B2RXH2 2/20 0.49
HSD17B10 Q99714 2/20 0.49
DPP4 P27487 2/20 0.49
APP P05067 2/20 0.49
BACE1 P56817 2/20 0.49
PTPN1 P18031 2/20 0.49
MAPT P10636 2/20 0.49
MEN1 O00255 1/20 0.49
HDAC3 O15379 1/20 0.49
CA12 O43570 1/20 0.49
AKR1B10 O60218 1/20 0.49
ALDH1A1 P00352 1/20 0.49
CA1 P00915 1/20 0.49

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
SCHEMBL28055089 1.00 PELI1 (0.53) PELI1IAPPPTGS1TTRMMP1
SCHEMBL30739974 1.00 PELI1 (0.53) PELI1IAPPPTGS1TTRMMP1
SCHEMBL5579317 0.85 KDM4E (0.51) PELI1IAPPPTGS1KDM4EHSD17B10
SCHEMBL21986720 0.84 IAPP (0.73) IAPPPTGS1TTRMMP1MMP2
SCHEMBL14472602 0.84 KDM4E (0.70) IAPPPTGS1TTRMMP1MMP2
SCHEMBL21986902 0.84 IAPP (0.73) IAPPPTGS1TTRMMP1MMP2
SCHEMBL29773361 0.83 KDM4E (0.69) PELI1IAPPPTGS1TTRMMP1
SCHEMBL8916399 0.83 KDM4E (0.69) PELI1IAPPPTGS1TTRMMP1
SCHEMBL1314851 0.83 KDM4E (0.69) PELI1IAPPPTGS1TTRMMP1
SCHEMBL16093012 0.81 IAPP (0.64) IAPPPTGS1TTRMMP1MMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110996930-B Novel benzalacetone derivative and use thereof 韩药有限公司 2024-02-02 CN claimed
US-20210139414-A1 NOVEL BENZYLIDENEACETONE DERIVATIVE AND USE THEREOF KORPHARM CO., LTD. (KR) 2021-05-13 US claimed
EP-3659592-A1 NOVEL BENZYLIDENEACETONE DERIVATIVE AND USE THEREOF Korpharm Co., Ltd. (KR) 2020-06-03 EP claimed
CN-110996930-A Novel benzylidene acetone derivative and use thereof 韩药有限公司 2020-04-10 CN claimed
CN-117653618-A Novel benzalacetone derivative and use thereof 韩药有限公司 2024-03-08 CN disclosed
CN-110996930-B Novel benzalacetone derivative and use thereof 韩药有限公司 2024-02-02 CN disclosed
US-11629121-B2 Benzylideneacetone derivative and use thereof KORPHARM CO., LTD. (KR) 2023-04-18 US disclosed
US-20210139414-A1 NOVEL BENZYLIDENEACETONE DERIVATIVE AND USE THEREOF KORPHARM CO., LTD. (KR) 2021-05-13 US disclosed
US-20210139414-A1 NOVEL BENZYLIDENEACETONE DERIVATIVE AND USE THEREOF KORPHARM CO., LTD. (KR) 2021-05-13 US disclosed
EP-3659592-A1 NOVEL BENZYLIDENEACETONE DERIVATIVE AND USE THEREOF Korpharm Co., Ltd. (KR) 2020-06-03 EP disclosed
CN-110996930-A Novel benzylidene acetone derivative and use thereof 韩药有限公司 2020-04-10 CN 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 (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-20210139414-A1 NOVEL BENZYLIDENEACETONE DERIVATIVE AND USE THEREOF EBP, CREBBP, BPTF PELI1 2876/4885IAPP 2237/4885PTGS1 413/4885
US-11629121-B2 Benzylideneacetone derivative and use thereof GNPAT, NAT1, ALDH7A1 PELI1 2730/4885IAPP 2353/4885PTGS1 1063/4885

“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.