SCHEMBL7048754

SCHEMBL7048754

C=Cc1cccc(NC)c1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
TSHR P16473 2/20 0.42
ALDH1A1 P00352 2/20 0.42
MEN1 O00255 1/20 0.39
POLB P06746 1/20 0.39
KMT2A Q03164 1/20 0.39
HDAC8 Q9BY41 2/20 0.36
PTGS2 P35354 1/20 0.36
KCNH2 Q12809 2/20 0.35
FAAH O00519 1/20 0.35
APP P05067 5/20 0.34
TRPA1 O75762 1/20 0.33
BRD4 O60885 1/20 0.33
CCKBR P32239 1/20 0.32
MAT2A P31153 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
Styrene SCHEMBL10628468 0.80 ALDH1A1 (0.64) TP53TDP1TSHRALDH1A1HDAC8
SCHEMBL2090802 0.79 TSHR (0.39) TSHRKCNH2APPMAT2A
SCHEMBL2090801 0.79 TSHR (0.39) TSHRKCNH2APPMAT2A
SCHEMBL95532 0.78 ALDH1A1 (0.48) TDP1TSHRALDH1A1PTGS2KCNH2
SCHEMBL14290425 0.78 TSHR (0.42) TP53TDP1TSHRALDH1A1MEN1
SCHEMBL9765849 0.78 TDP1 (0.48) TP53TDP1TSHRALDH1A1MEN1
SCHEMBL7024378 0.78 TP53 (0.48) TP53TDP1TSHRALDH1A1MEN1
SCHEMBL6653366 0.78 TDP1 (0.48) TP53TDP1TSHRALDH1A1MEN1
Hydrochloric Acid SCHEMBL9789740 0.77 TDP1 (0.47) TP53TDP1TSHRALDH1A1MEN1
SCHEMBL22369239 0.77 TSHR (0.41) TSHRKCNH2APP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3456757-B1 POLYIMIDE RESIN AND POLYIMIDE RESIN COMPOSITION MITSUBISHI GAS CHEMICAL CO (JP) 2023-06-07 EP disclosed
CN-109046463-B Bidentate aza-carbene-manganese catalyst, preparation method and alkylation synthesis application thereof 中山大学 2021-05-04 CN disclosed
CN-104880908-B Photosensitive resin composition 住友化学株式会社 2019-12-13 CN disclosed
EP-1761523-B1 USE OF TRIAZINYL FLAVONATE BRIGHTENERS BLANKOPHOR GMBH & CO KG (DE) 2015-11-04 EP disclosed
US-7598009-B2 Photosensitive resin composition, production method for cured relief pattern using it, and semiconductor device FUJIFILM CORPORATION (JP) 2009-10-06 US disclosed
US-20090035693-A1 PHOTOSENSITIVE RESIN COMPOSITION, PRODUCTION METHOD FOR CURED RELIEF PATTERN USING IT, AND SEMICONDUCTOR DEVICE FUJIFILM CORPORATION (JP) 2009-02-05 US disclosed
US-7329660-B2 Phthalazine derivatives for treating inflammatory diseases NOVARTIS AG (CH) 2008-02-12 US disclosed
US-7329660-B2 Phthalazine derivatives for treating inflammatory diseases NOVARTIS AG (CH) 2008-02-12 US disclosed
WO-2004058234-A2 PHARMACEUTICAL COMBINATIONS OF PHTHALAZINE VEGF INHIBITORS AND BENZAMIDE HDAC INHIBITORS SCHERING AKTIENGESELLSCHAFT (DE) 2004-07-15 WO disclosed
US-20030130510-A1 Process for producing N-hydroxyalkyl compound, and tris (2-hydroxyethyl) isocyanurate composition NIPPON SHOKUBAI CO., LTD. 2003-07-10 US disclosed
EP-1323706-A1 Process for producing N-hydroxyalkyl compound, and tris(2-hydroxyethyl) isocyanurate composition Nippon Shokubai Co., Ltd. (JP) 2003-07-02 EP disclosed
EP-0859284-A1 Water-developable photosensitive composition and production process thereof Nippon Paint Co., Ltd. (JP) 1998-08-19 EP disclosed
US-5736298-A COMPRISES A PARTICULATE POLYMER OF A CARBOXY-GROUP-CONTAINING-DIENE HAVING A CROSSLINKED STRUCTURE JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1998-04-07 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-20030130510-A1 Process for producing N-hydroxyalkyl compound, and tris (2-hydroxyethyl) isocyanurate composition HAAO, ALKBH3, FTO TP53 4299/4885TDP1 2009/4885TSHR 3929/4885

“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.