SCHEMBL5872279

SCHEMBL5872279

C=CCCCCCC#CCCCCCCCCC

nearest known ligand 0.73

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.73
ALDH1A1 P00352 2/20 0.56
PTPN7 P35236 5/20 0.45
HMGCR P04035 4/20 0.45
RECQL P46063 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
USP2 O75604 1/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
ALOX12 P18054 1/20 0.38
BLM P54132 1/20 0.38
KMT2A Q03164 1/20 0.38
MCL1 Q07820 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TRPA1 O75762 1/20 0.38

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
SCHEMBL8211719 1.00 TSHR (0.73) TSHRALDH1A1PTPN7HMGCRRECQL
SCHEMBL6576796 1.00 TSHR (0.73) TSHRALDH1A1PTPN7HMGCRRECQL
SCHEMBL28701951 0.95 TSHR (0.65) TSHRALDH1A1PTPN7HMGCRRECQL
SCHEMBL8213043 0.95 TSHR (0.65) TSHRALDH1A1PTPN7HMGCRRECQL
SCHEMBL7279691 0.93 TSHR (0.61) TSHRALDH1A1PTPN7HMGCRRECQL
SCHEMBL10804043 0.93 TSHR (0.61) TSHRALDH1A1PTPN7HMGCRRECQL
SCHEMBL8211279 0.91 TSHR (0.58) TSHRALDH1A1PTPN7HMGCRRECQL
SCHEMBL7276371 0.88 TSHR (0.54) TSHRALDH1A1PTPN7HMGCRRECQL
SCHEMBL28156587 0.88 TSHR (0.94) TSHRALDH1A1MAPT
SCHEMBL28091897 0.88

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8912113-B2 Compositions of a metal amidine complex and second compound, coating compositions comprising same KING INDUSTRIES, INC. (US) 2014-12-16 US disclosed
EP-2683767-A1 COMPOSITIONS OF A METAL AMIDINE COMPLEX AND SECOND COMPOUND, COATING COMPOSITIONS COMPRISING SAME KING INDUSTRIES, INC. (US) 2014-01-15 EP disclosed
WO-2012122098-A1 COMPOSITIONS OF A METAL AMIDINE COMPLEX AND SECOND COMPOUND, COATING COMPOSITIONS COMPRISING SAME KING INDUSTRIES, INC. (US) 2012-09-13 WO disclosed
US-20120225982-A1 COMPOSITIONS OF A METAL AMIDINE COMPLEX AND SECOND COMPOUND, COATING COMPOSITIONS COMPRISING SAME KING INDUSTRIES, INC. 2012-09-06 US disclosed
US-7109259-B2 Piperazinone derivatives CIBA SPECIALTY CHEMICALS CORPORATION (US) 2006-09-19 US disclosed
US-20030027902-A1 Piperazinone derivatives LAZZARI DARIO (IT) 2003-02-06 US disclosed
EP-1053228-A1 PERYLENE IMIDE MONOCARBOXYLIC ACIDS AS COLORANTS Ciba SC Holding AG (CH) 2000-11-22 EP disclosed
WO-1999031069-A1 PERYLENE IMIDE MONOCARBOXYLIC ACIDS AS COLORANTS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 1999-06-24 WO disclosed
EP-0835289-B1 AMINOSILANE SALTS AND SILANAMIDES OF CARBOXYLIC ACIDS AS CORROSION INHIBITORS CIBA GEIGY AG (CH) 1999-05-19 EP disclosed
US-5879436-A REACTION PRODUCT OF CARBOXYLIC ACID AND AMINOSILANE; PROTECTIVE COATINGS CIBA SPECIALTY CHEMICALS CORPORATION (US) 1999-03-09 US disclosed
US-5777113-A Hals phosphorinanes as stabilisers CIBA SPECIALTY CHEMICALS CORPORATION (US) 1998-07-07 US disclosed
US-5777008-A OXIDATION RESISTANCE, HEAT RESISTANCE, RADIATION RESISTANCE CIBA SPECIALTY CHEMICALS CORPORATION (US) 1998-07-07 US disclosed
EP-0835289-A1 AMINOSILANE SALTS AND SILANAMIDES OF CARBOXYLIC ACIDS AS CORROSION INHIBITORS Ciba SC Holding AG (CH) 1998-04-15 EP disclosed
US-5612093-A Titanium and zirconium complexes of carboxylic acids as corrosion inhibitors CIBA-GEIGY CORPORATION (US) 1997-03-18 US disclosed
US-5602196-A OXIDATION AND HEAT RESISTANCE; PHOTOSTABILITY CIBA-GEIGY CORPORATION (US) 1997-02-11 US disclosed
WO-1997001606-A1 AMINOSILANE SALTS AND SILANAMIDES OF CARBOXYLIC ACIDS AS CORROSION INHIBITORS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 1997-01-16 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-20030027902-A1 Piperazinone derivatives H1-4, EIF4G1, GPX4 TSHR 4191/4885ALDH1A1 94/4885PTPN7 4794/4885

“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.