SCHEMBL4804883

SCHEMBL4804883

C=C(C(=O)O)c1cccc(-c2ccccc2)c1

nearest known ligand 0.64

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMO O15229 1/20 0.62
HDAC8 Q9BY41 1/20 0.56
ERCC5 P28715 1/20 0.56
FEN1 P39748 1/20 0.56
PRSS1 P07477 1/20 0.50
PRSS2 P07478 1/20 0.50
PRSS3 P35030 1/20 0.50
GPR52 Q9Y2T5 1/20 0.47
DHODH Q02127 1/20 0.47
RXRA P19793 1/20 0.46
RXRB P28702 1/20 0.46
KAT6A Q92794 1/20 0.45
MGLL Q99685 1/20 0.44
EPHX2 P34913 1/20 0.44
NR1H4 Q96RI1 1/20 0.44
MAPT P10636 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
FAAH O00519 1/20 0.44
NAAA Q02083 1/20 0.44

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
SCHEMBL10362484 0.86 SIRT2 (0.52) KMOKAT6A
SCHEMBL30526043 0.85 KMO (0.46) KMOHDAC8ERCC5FEN1MAPT
SCHEMBL271385 0.85 L3MBTL1 (0.52) KMOTDP1
SCHEMBL8154868 0.85 KMO (0.58) KMOHDAC8ERCC5FEN1PRSS1
SCHEMBL30526046 0.83 MEN1 (0.53) MAPT
SCHEMBL29048682 0.83 MEN1 (0.53) MAPT
SCHEMBL28905107 0.81 KAT6A (0.53) KMOERCC5FEN1KAT6AMAPT
SCHEMBL28510623 0.81 ALDH1A1 (0.48) KMOHDAC8ERCC5FEN1GPR52
SCHEMBL31425654 0.81 SMN1; SMN2 (0.50) KMOERCC5FEN1RXRARXRB
SCHEMBL36308 0.81 SMN1; SMN2 (0.56) ERCC5FEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110438523-B Catalyst-free electrochemical deuteration method taking heavy water as deuterium source 南京大学 2021-12-03 CN claimed
CN-110438523-A A kind of using heavy water is deuterium source without the deuterated method of catalyst electrochemistry NANJING UNIVERSITY OF TECHNOLOGY 2019-11-12 CN disclosed
CN-105717746-A Photosensitive polysiloxane composition, protective film and element with protective film 奇美实业股份有限公司 2016-06-29 CN disclosed
US-7416821-B2 Thermally cured undercoat for lithographic application FUJIFILM ELECTRONIC MATERIALS, U.S.A., INC. (US) 2008-08-26 US disclosed
EP-1743363-A2 THERMALLY CURED UNDERCOAT FOR LITHOGRAPHIC APPLICATION FujiFilm Electronic Materials USA, Inc. (US) 2007-01-17 EP disclosed
US-20050238997-A1 Thermally cured undercoat for lithographic application FUJIFILM ELECTRONIC MATERIALS, U.S.A., INC. 2005-10-27 US disclosed
WO-2005089150-A2 THERMALLY CURED UNDERCOAT FOR LITHOGRAPHIC APPLICATION FUJIFILM ELECTRONIC MATERIALS USA INC. (US) 2005-09-29 WO disclosed
US-6911468-B2 Tyrosine phosphatase inhibitors TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2005-06-28 US disclosed
US-20030144338-A1 Tyrosine phosphatase inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2003-07-31 US disclosed
EP-1284260-A1 TYROSINE PHOSPHATASE INHIBITORS Takeda Chemical Industries, Ltd. (JP) 2003-02-19 EP 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-20030144338-A1 Tyrosine phosphatase inhibitors PTPRC, PTPN1, PTPRM KMO 2370/4885HDAC8 1090/4885ERCC5 4511/4885

“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.