SCHEMBL998638

SCHEMBL998638

C=CC(=O)c1ccc2c(c1)OCO2

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.62
MAPK1 P28482 1/20 0.62
NPC1 O15118 4/20 0.59
MAPT P10636 4/20 0.59
RAB9A P51151 4/20 0.59
KMT2A Q03164 3/20 0.58
MEN1 O00255 2/20 0.58
SMN1; SMN2 Q16637 3/20 0.57
NFKB1 P19838 2/20 0.57
NFKB2 Q00653 2/20 0.57
RELA Q04206 2/20 0.57
GAA P10253 1/20 0.57
MAOA P21397 2/20 0.56
MAOB P27338 1/20 0.56
SRD5A2 P31213 1/20 0.56
ATM Q13315 2/20 0.55
HPGD P15428 2/20 0.53
PKM P14618 1/20 0.53
GPR55 Q9Y2T6 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52

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
SCHEMBL999704 0.89 TSHR (0.61) ALDH1A1NPC1MAPTRAB9AKMT2A
SCHEMBL29383324 0.89 TSHR (0.61) ALDH1A1NPC1MAPTRAB9AKMT2A
SCHEMBL19243173 0.84 ALDH1A1 (0.65) ALDH1A1MAPK1NPC1MAPTRAB9A
SCHEMBL7075198 0.84 ALDH1A1 (0.65) ALDH1A1MAPK1NPC1MAPTRAB9A
SCHEMBL28963614 0.82 ALDH1A1 (0.62) ALDH1A1MAPK1NPC1MAPTRAB9A
SCHEMBL10728217 0.82 ALDH1A1 (0.62) ALDH1A1MAPK1NPC1MAPTRAB9A
SCHEMBL10057828 0.81 ALDH1A1 (0.66) ALDH1A1MAPK1NPC1MAPTRAB9A
SCHEMBL5416122 0.79 ALDH1A1 (0.69) ALDH1A1MAPK1NPC1MAPTRAB9A
SCHEMBL31322028 0.79 MAPT (0.68) ALDH1A1MAPK1NPC1MAPTRAB9A
SCHEMBL11095416 0.79 MAPT (0.68) ALDH1A1MAPK1NPC1MAPTRAB9A

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-110938845-A Plating solution for electrolytic tinning 上村工业株式会社 2020-03-31 CN claimed
US-20200095698-A1 ELECTROLYTIC TIN PLATING SOLUTION C. UYEMURA & CO., LTD. (JP) 2020-03-26 US claimed
CN-110938845-A Plating solution for electrolytic tinning 上村工业株式会社 2020-03-31 CN disclosed
US-20200095698-A1 ELECTROLYTIC TIN PLATING SOLUTION C. UYEMURA & CO., LTD. (JP) 2020-03-26 US disclosed
US-9359277-B2 Compositions and processes of preparing and using the same PURDUE RESEARCH FOUNDATION (US) 2016-06-07 US disclosed
US-9359277-B2 Compositions and processes of preparing and using the same PURDUE RESEARCH FOUNDATION (US) 2016-06-07 US disclosed
US-20140039182-A1 COMPOSITIONS AND PROCESSES OF PREPARING AND USING THE SAME PURDUE RESEARCH FOUNDATION 2014-02-06 US disclosed
US-20140039182-A1 COMPOSITIONS AND PROCESSES OF PREPARING AND USING THE SAME PURDUE RESEARCH FOUNDATION 2014-02-06 US disclosed
WO-2012129384-A2 COMPOSITIONS AND PROCESSES OF PREPARING AND USING THE SAME PURDUE RESEARCH FOUNDATION (US) 2012-09-27 WO disclosed
WO-2011009826-A2 NOVEL CHALCONE DERIVATIVES WITH CYTOTOXIC ACTIVITY ADAMED Sp.z o.o. (PL) 2011-01-27 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 (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-20140039182-A1 COMPOSITIONS AND PROCESSES OF PREPARING AND USING THE SAME DBF4, FAU, DHX29 ALDH1A1 2102/4885MAPK1 2698/4885NPC1 422/4885

“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.