SCHEMBL10031362

SCHEMBL10031362

Cc1cc2sc3c4cc(C)c(C)cc4sc3c2cc1C

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.39
ALDH1A1 P00352 2/20 0.37
TP53 P04637 1/20 0.37
CYP3A4 P08684 1/20 0.37
TSHR P16473 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MAPT P10636 3/20 0.32
HCRTR1 O43613 1/20 0.32
LMNA P02545 1/20 0.32
POLB P06746 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
KDM4E B2RXH2 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
SCHEMBL10031384 0.95 GAA (0.37) GAAALDH1A1TP53CYP3A4TSHR
SCHEMBL16978723 0.91 GAA (0.39) GAAALDH1A1TP53CYP3A4TSHR
SCHEMBL12211694 0.85 KDM4E (0.32) GAAMAPTKDM4E
SCHEMBL1105190 0.84 GAA (0.37) GAAALDH1A1TP53CYP3A4TSHR
SCHEMBL11976505 0.82 GAA (0.42) GAAALDH1A1TP53CYP3A4TSHR
SCHEMBL9976852 0.82 GAA (0.35) GAAALDH1A1TP53CYP3A4TSHR
SCHEMBL15497412 0.82 GAA (0.35) GAAALDH1A1TP53CYP3A4TSHR
SCHEMBL10031356 0.80 ILK (0.33) GAATP53MAPT
SCHEMBL10031358 0.80 CD44 (0.39) GAAALDH1A1CYP3A4MAPTHCRTR1
SCHEMBL16978725 0.79 MAPT (0.45) GAAALDH1A1TP53TSHRSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9680112-B2 Semiconductor composition SAMSUNG ELECTRONICS CO., LTD. (KR) 2017-06-13 US disclosed
US-9260451-B2 Method for producing aromatic compound NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2016-02-16 US disclosed
US-9260451-B2 Method for producing aromatic compound NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2016-02-16 US disclosed
US-9203038-B2 Electronic device SAMSUNG ELECTRONICS CO., LTD. (KR) 2015-12-01 US disclosed
US-20150239901-A1 Method For Producing Aromatic Compound NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2015-08-27 US disclosed
US-20150239901-A1 Method For Producing Aromatic Compound NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2015-08-27 US disclosed
US-20150123041-A1 SEMICONDUCTOR COMPOSITION SAMSUNG ELECTRONICS CO LTD (KR) 2015-05-07 US disclosed
US-20150053961-A1 ELECTRONIC DEVICE SAMSUNG ELECTRONICS CO LTD (KR) 2015-02-26 US disclosed
US-8963131-B2 Electronic device SAMSUNG ELECTRONICS CO., LTD. (KR) 2015-02-24 US disclosed
US-8945425-B2 Semiconductor composition SAMSUNG ELECTRONICS CO., LTD. (KR) 2015-02-03 US disclosed
US-8643001-B2 Semiconductor composition SAMSUNG ELECTRONICS CO. LTD. (KR) 2014-02-04 US disclosed
US-20120313081-A1 ELECTRONIC DEVICE XEROX CORPORATION (US) 2012-12-13 US disclosed
US-20120261648-A1 SEMICONDUCTOR COMPOSITION XEROX CORPORATION (US) 2012-10-18 US disclosed
US-20120161110-A1 SEMICONDUCTOR COMPOSITION XEROX CORPORATION (US) 2012-06-28 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-20150239901-A1 Method For Producing Aromatic Compound TYR, XDH, CYP1A1 GAA 3981/4885ALDH1A1 806/4885TP53 2733/4885

“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.