SCHEMBL26915

SCHEMBL26915

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

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 4/20 0.70
TSHR P16473 1/20 0.61
LMNA P02545 2/20 0.58
TYR P14679 1/20 0.58
NPC1 O15118 5/20 0.52
RAB9A P51151 5/20 0.52
XDH P47989 1/20 0.52
KDM4E B2RXH2 2/20 0.46
HTR1D P28221 1/20 0.46
ADRA1A P35348 1/20 0.46
NISCH Q9Y2I1 1/20 0.46
ALDH1A1 P00352 4/20 0.46
TP53 P04637 2/20 0.45
MITF O75030 1/20 0.45
KMT2A Q03164 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
HPGD P15428 2/20 0.44
MAPT P10636 1/20 0.44
MAPK1 P28482 1/20 0.44
HDAC1 Q13547 1/20 0.44

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
SCHEMBL3423876 1.00 KIF11 (0.70) KIF11TSHRLMNATYRNPC1
SCHEMBL1931781 0.97 KIF11 (0.67) KIF11TSHRLMNATYRNPC1
SCHEMBL23319641 0.91 KIF11 (0.61) KIF11TSHRLMNATYRNPC1
SCHEMBL4322427 0.91 KIF11 (0.61) KIF11TSHRLMNATYRNPC1
SCHEMBL424728 0.89 TSHR (0.73) KIF11TSHRLMNATYRNPC1
SCHEMBL3421942 0.88 KIF11 (0.59) KIF11TSHRLMNATYRNPC1
SCHEMBL19192713 0.88 TSHR (0.83) KIF11TSHRLMNATYRNPC1
SCHEMBL128222 0.88 KIF11 (0.59) KIF11TSHRLMNATYRNPC1
SCHEMBL24599236 0.88 TSHR (0.83) KIF11TSHRLMNATYRNPC1
SCHEMBL2655921 0.86 NPC1 (0.64) KIF11TSHRLMNATYRNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260117396-A1 AMMONIA PRODUCTION METHOD UNIV NAT TAIWAN SCIENCE & TECHNOLOGY (TW) 2026-04-30 US claimed
EP-4733441-A1 AMMONIA PRODUCTION METHOD National Taiwan University of Science and Technology (TW) 2026-04-29 EP claimed
WO-2024263819-A2 BORON-CONTAINING COMPOUNDS AND METHODS OF PREPARATION AND APPLICATIONS THEREOF THE TRUSTEES OF BOSTON COLLEGE (US) 2024-12-26 WO claimed
WO-2024224517-A1 METHOD FOR PRODUCING SINGLE-CRYSTAL SPHERICAL SODIUM METAL NANOPARTICLES エム・テクニック株式会社 2024-10-31 WO claimed
CN-117886790-A Synthesis method of CochlearolB 陕西师范大学 2024-04-16 CN claimed
WO-2024058239-A1 HOLE TRANSPORTING MATERIAL FOR PHOTOELECTRIC CONVERSION ELEMENT FOR IMAGING ELEMENT OR ELECTRON BLOCKING MATERIAL FOR PHOTOELECTRIC CONVERSION ELEMENT FOR IMAGING ELEMENT, CONDENSED RING COMPOUND PRODUCTION METHOD, AND CONDENSED RING COMPOUND 東ソー株式会社 2024-03-21 WO claimed
CN-116947925-A Bridged biphenyl monophosphine ligand containing benzofuran structure, and preparation method and application thereof 中山大学 2023-10-27 CN claimed
EP-3478669-B1 PROCESS OF PREPARING A PEPTIDE EPOXYKETONE IMMUNOPROTEASOME INHIBITOR KEZAR LIFE SCIENCES (US) 2023-08-30 EP claimed
CN-116135866-A Bridged carboxylic acid-containing difunctional phosphine ligand, preparation method and application thereof 中山大学 2023-05-19 CN claimed
EP-3068726-B1 PREPARATION OF FUNCTIONALISED MATERIALS IMPERIAL COLLEGE INNOVATIONS LTD (GB) 2023-03-22 EP claimed
US-20080188671-A1 Simple, inexpensive synthesis of high yield and purity Suzuki coupling compounds; inhibiting rearrangement ARCHIMICA GMBH (DE) 2008-08-07 US claimed
EP-1885729-A2 METHOD FOR PRODUCING 2-FORMYLFURAN-4-BORONIC ACID BY THE METALATION OF 4-HALOFURFURAL ACETALS IN THE PRESENCE OF SUITABLE BORONIC ACID ESTERS OR ANHYDRIDES Archimica GmbH (DE) 2008-02-13 EP claimed
WO-2006122683-A2 METHOD FOR PRODUCING 2-FORMYLFURAN-4-BORONIC ACID ARCHIMICA GMBH (DE) 2006-11-23 WO claimed
EP-1295887-B1 Preparation of pure aryl lithium compounds CHEMETALL GMBH (DE) 2006-08-02 EP claimed
US-20050272963-A1 Method for the production of acetylene alcohols BASF AKTIENGESELLSCHAFT (DE) 2005-12-08 US claimed
EP-1295887-A1 Preparation of pure aryl lithium compounds and their use Chemetall GmbH (DE) 2003-03-26 EP claimed
US-6503662-B1 Tert-butylbenzene derivative prevents oxidation and decomposition of solvent at the time of charging which causes decreased battery characteristics UBE INDUSTRIES, LTD. (JP) 2003-01-07 US claimed
US-5929262-A Method for preparing 17α-acetoxy-11β-(4-N, N-dimethylaminophyl)-19-Norpregna-4,9-diene-3, 20-dione, intermediates useful in the method, and methods for the preparation of such intermediates THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1999-07-27 US claimed
EP-0817793-A2 METHOD FOR PREPARING 17ALPHA-ACETOXY-11BETA-(4-N,N-DIMETHYLAMINOPHENYL)-19-NORPREGNA-4,9-DIENE-3,20-DIONE, INTERMEDIATES USEFUL IN THE METHOD, AND METHODS FOR THE PREPARATION OF SUCH INTERMEDIATES. THE UNITED STATES OF AMERICA, as represented by THE SECRETARY, Department of Health and Human Services (US) 1998-01-14 EP claimed
WO-1996030390-A2 METHOD FOR PREPARING 17α-ACETOXY-11β-(4-N,N-DIMETHYLAMINOPHENYL)-19-NORPREGNA-4,9-DIENE-3,20-DIONE, INTERMEDIATES USEFUL IN THE METHOD, AND METHODS FOR THE PREPARATION OF SUCH INTERMEDIATES. THE UNITED STATES OF AMERICA, REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1996-10-03 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 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-20260117396-A1 AMMONIA PRODUCTION METHOD HCN4, HCN2, HCN3 KIF11 3895/4885TSHR 1899/4885LMNA 758/4885
US-20080188671-A1 Simple, inexpensive synthesis of high yield and purity Suzuki coupling compounds; inhibiting rearrangement CBR3, CBR1, BLVRB KIF11 959/4885TSHR 41/4885LMNA 3625/4885
US-20050272963-A1 Method for the production of acetylene alcohols ADH1A, ADH1C, AKR1B10 KIF11 1575/4885TSHR 295/4885LMNA 1309/4885

“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.