SCHEMBL707103

SCHEMBL707103

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nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.59
KDM4E B2RXH2 1/20 0.59
GRIK1 P39086 5/20 0.44
GRIK2 Q13002 4/20 0.44
LDHA P00338 1/20 0.44
SRR Q9GZT4 1/20 0.44
CPB1 P15086 1/20 0.42
CYP2C19 P33261 1/20 0.41
RECQL P46063 1/20 0.39
ALOX15 P16050 2/20 0.37
HSD17B10 Q99714 1/20 0.37
FFAR3 O14843 1/20 0.35
ABAT P80404 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP2D6 P10635 1/20 0.32
GRIA2 P42262 2/20 0.31
GRIA4 P48058 2/20 0.31
GRIK3 Q13003 2/20 0.31
GRIK5 Q16478 2/20 0.31
GRIA1 P42261 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
SCHEMBL6365923 1.00 TSHR (0.59) TSHRKDM4EGRIK1GRIK2LDHA
SCHEMBL33410 1.00 TSHR (0.59) TSHRKDM4EGRIK1GRIK2LDHA
SCHEMBL7076812 0.97 TSHR (0.56) TSHRKDM4EGRIK1GRIK2LDHA
Ammonia Solution, Strong SCHEMBL28249079 0.97 TSHR (0.56) TSHRKDM4EGRIK1GRIK2LDHA
SCHEMBL11743391 0.97 TSHR (0.56) TSHRKDM4EGRIK1GRIK2LDHA
Hydrochloric Acid SCHEMBL28241597 0.95 TSHR (0.54) TSHRKDM4EGRIK1GRIK2LDHA
SCHEMBL27804216 0.88 TSHR (0.48) TSHRKDM4EGRIK1GRIK2LDHA
Acrylic Acid SCHEMBL29198707 0.88 ALOX15 (0.56) TSHRKDM4EGRIK1GRIK2LDHA
Itaconate SCHEMBL10984223 0.86 ALOX15 (0.59) TSHRKDM4EGRIK1GRIK2LDHA
Dimethyl Fumarate SCHEMBL5077436 0.84 HCAR2 (0.54) TSHRKDM4EGRIK1GRIK2LDHA

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
US-20150291986-A1 ITACONIC ACID AND ITACONATE METHYLESTER PRODUCTION DSM IP ASSETS B.V. (NL) 2015-10-15 US disclosed
US-8404738-B2 4-amino-N-hydroxy-benzamides for the treatment of cancer HOFFMANN-LA ROCHE INC. (US) 2013-03-26 US disclosed
US-8404738-B2 4-amino-N-hydroxy-benzamides for the treatment of cancer HOFFMANN-LA ROCHE INC. (US) 2013-03-26 US disclosed
WO-2012162175-A1 EMETINE DERIVATIVES, PRODRUGS CONTAINING SAME, AND METHODS OF TREATING CONDITIONS USING SAME HOWARD UNIVERSITY (US) 2012-11-29 WO disclosed
US-20120190700-A1 NOVEL 4-AMINO-N-HYDROXY-BENZAMIDES FOR THE TREATMENT OF CANCER HOFFMANN-LA ROCHE INC. 2012-07-26 US disclosed
US-20120190700-A1 NOVEL 4-AMINO-N-HYDROXY-BENZAMIDES FOR THE TREATMENT OF CANCER HOFFMANN-LA ROCHE INC. 2012-07-26 US disclosed
WO-2012098132-A1 NOVEL 4-AMINO-N-HYDROXY-BENZAMIDES AS HDAC INHIBITORS FOR THE TREATMENT OF CANCER F. HOFFMANN-LA ROCHE AG (CH) 2012-07-26 WO disclosed
US-8124174-B2 Electroless gold plating method and electronic parts C. UYEMURA & CO., LTD. (JP) 2012-02-28 US disclosed
US-7511023-B2 adriamycin; chemotherapy; sustained release KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2009-03-31 US disclosed
US-20080277140-A1 ELECTROLESS GOLD PLATING METHOD AND ELECTRONIC PARTS C. UYEMURA & CO., LTD. (JP) 2008-11-13 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-20120190700-A1 NOVEL 4-AMINO-N-HYDROXY-BENZAMIDES FOR THE TREATMENT OF CANCER HRH4, H1-4, HNMT TSHR 1863/4885KDM4E 47/4885GRIK1 2027/4885

“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.