SCHEMBL292572

SCHEMBL292572

CC(C)(C)c1ccc(C(c2ccc(C(C)(C)C)cc2)c2ccc(C(C)(C)C)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.52
LMNA P02545 2/20 0.50
TYR P14679 1/20 0.50
GRIA4 P48058 3/20 0.42
KIF11 P52732 2/20 0.42
ALDH1A1 P00352 5/20 0.41
NR1H4 Q96RI1 1/20 0.40
HPGD P15428 2/20 0.39
NPC1 O15118 1/20 0.39
MAPT P10636 1/20 0.39
MAPK1 P28482 1/20 0.39
RAB9A P51151 1/20 0.39
HDAC1 Q13547 1/20 0.39
SLC22A2 O15244 1/20 0.39
SLC22A1 O15245 1/20 0.39
SLC22A3 O75751 1/20 0.39
HSD17B10 Q99714 2/20 0.39
TP53 P04637 1/20 0.39
ALOX15 P16050 1/20 0.39
TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL16487204 0.90 SLC6A2 (0.44) TSHRLMNATYRALDH1A1NR1H4
SCHEMBL25380412 0.88 LMNA (0.73) TSHRLMNATYRALDH1A1HPGD
SCHEMBL22402545 0.88 TRPV1 (0.46) TSHRLMNATYRGRIA4KIF11
SCHEMBL13523895 0.88 RAB9A (0.57) TSHRLMNATYRGRIA4KIF11
SCHEMBL18175849 0.82 KIF11 (0.45) TSHRLMNATYRGRIA4KIF11
SCHEMBL424728 0.80 TSHR (0.73) TSHRLMNATYRKIF11ALDH1A1
SCHEMBL548066 0.80 TSHR (0.50) TSHRLMNATYRGRIA4KIF11
SCHEMBL9621026 0.80 TSHR (0.50) TSHRLMNATYRGRIA4KIF11
SCHEMBL8986298 0.79 TSHR (0.35) TSHRLMNATYRGRIA4KIF11
SCHEMBL18892919 0.78 CYP1A2 (0.44) TSHRLMNAALDH1A1HPGDNPC1

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 155 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2727915-B1 Synthesis of deuterated catechols and benzo[d][1,3]dioxoles and derivatives thereof CONCERT PHARMACEUTICALS INC (US) 2016-04-13 EP claimed
EP-2727915-A1 Synthesis of deuterated catechols and benzo[d][1,3]dioxoles and derivatives thereof Concert Pharmaceuticals Inc. (US) 2014-05-07 EP claimed
US-7232634-B2 Charge generating layer and a charge transport layer with bulky organic groups to prevent recrystallization of the charge transport molecule and shield the nitrogen from molecular attack; oxidation reisitance, wear resistance XEROX CORPORATION (US) 2007-06-19 US claimed
EP-0906329-B1 2'-SUBSTITUTED NUCLEOSIDES AND OLIGONUCLEOTIDE DERIVATIVES NOVARTIS AG (CH) 2003-10-08 EP claimed
EP-0906329-A2 2'-SUBSTITUTED NUCLEOSIDES AND OLIGONUCLEOTIDE DERIVATIVES Novartis AG (CH) 1999-04-07 EP claimed
WO-1997046569-A2 2'-SUBSTITUTED NUCLEOSIDES AND OLIGONUCLEOTIDE DERIVATIVES NOVARTIS AG (CH) 1997-12-11 WO claimed
US-20240166666-A1 ANTITUMORAL COMPOUNDS PHARMA MAR SA (ES) 2024-05-23 US disclosed
US-20240131180-A1 DRUG ANTIBODY CONJUGATES PHARMA MAR, S.A. (ES) 2024-04-25 US disclosed
WO-2024074604-A1 COMPOUNDS FOR THE MANAGEMENT OF CELL STEMNESS AND INVASION IN CANCER AND RELATED DISEASES INSTITUTO BIOMAR, S.A (ES) 2024-04-11 WO disclosed
EP-4349409-A1 COMPOUNDS FOR THE MANAGEMENT OF CELL STEMNESS AND INVASION IN CANCER AND RELATED DISEASES Instituto Biomar S.A. (ES) 2024-04-10 EP disclosed
EP-4025253-B1 DRUG ANTIBODY CONJUGATES PHARMA MAR SA (ES) 2024-03-20 EP disclosed
EP-3615544-B9 ANTITUMORAL COMPOUNDS PHARMA MAR SA (ES) 2024-01-03 EP disclosed
EP-4101855-B9 ANTITUMORAL COMPOUNDS PHARMA MAR SA (ES) 2024-01-03 EP disclosed
US-20060068309-A1 Imaging member XEROX CORPORATION 2006-03-30 US disclosed
EP-0906329-B1 2'-SUBSTITUTED NUCLEOSIDES AND OLIGONUCLEOTIDE DERIVATIVES NOVARTIS AG (CH) 2003-10-08 EP disclosed
EP-0906329-A2 2'-SUBSTITUTED NUCLEOSIDES AND OLIGONUCLEOTIDE DERIVATIVES Novartis AG (CH) 1999-04-07 EP disclosed
WO-1998056905-A1 OLIGONUCLEOTIDE DERIVATIVES NOVARTIS AG (CH) 1998-12-17 WO disclosed
WO-1997046569-A2 2'-SUBSTITUTED NUCLEOSIDES AND OLIGONUCLEOTIDE DERIVATIVES NOVARTIS AG (CH) 1997-12-11 WO disclosed
US-5639867-A TTTr as protective group in nucleotide synthesis CIBA GEIGY CORPORATION (US) 1997-06-17 US disclosed
US-5268464-A Process for the preparation of nucleosides CIBA-GEIGY CORPORATION (US) 1993-12-07 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 (2 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-20240131180-A1 DRUG ANTIBODY CONJUGATES STT3B, STT3A, TTL TSHR 1530/4885LMNA 1254/4885TYR 428/4885
US-20240166666-A1 ANTITUMORAL COMPOUNDS TP53, TOP1, MCL1 TSHR 4670/4885LMNA 1898/4885TYR 808/4885

“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.