SCHEMBL14716768

SCHEMBL14716768

CC(C)c1cc(C(C)C)c(-c2cccc(Cl)c2P(C2CCCCC2)C2CCCCC2)c(C(C)C)c1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 1/20 0.58
EPHX2 P34913 1/20 0.32
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
NFKB1 P19838 1/20 0.31
PNMT P11086 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
GLA P06280 1/20 0.31
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL30785325 0.99 ROCK2 (0.57) ROCK2EPHX2CYP1A2CYP3A4CYP2D6
SCHEMBL31338586 0.99 ROCK2 (0.57) ROCK2EPHX2CYP1A2CYP3A4CYP2D6
SCHEMBL21331820 0.91 ROCK2 (0.64) ROCK2EPHX2
SCHEMBL29548021 0.90 ROCK2 (0.44) ROCK2CYP1A2CYP3A4CYP2D6NFKB1
SCHEMBL30788622 0.89 ROCK2 (0.62) ROCK2EPHX2
SCHEMBL30714841 0.85 ROCK2 (0.58) ROCK2EPHX2
SCHEMBL30956271 0.85 ROCK2 (0.58) ROCK2
SCHEMBL19712320 0.85 ROCK2 (0.44) ROCK2
SCHEMBL25338156 0.82 ROCK2 (0.55) ROCK2
SCHEMBL30615146 0.81 ROCK2 (0.54) ROCK2EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4745179-A1 METHOD FOR PRODUCING ARYLAMINE POLYMER Resonac Corporation (JP) 2026-05-20 EP claimed
US-20260125395-A1 PROCESS FOR THE PREPARATION OF TRICYCLIC PI3K INHIBITOR COMPOUNDS AND METHODS FOR USING THE SAME FOR THE TREATMENT OF CANCER GENENTECH INC (US) 2026-05-07 US claimed
CN-113999249-B Methods for preparing tricyclic PI3K inhibitor compounds and methods of treating cancer using the same 基因泰克公司 2025-03-25 CN claimed
WO-2025013810-A1 METHOD FOR PRODUCING ARYLAMINE POLYMER 株式会社レゾナック 2025-01-16 WO claimed
CN-113999240-B Conjugated condensed ring macrocyclic material containing hetero atoms, and preparation method and application thereof 复旦大学 2023-09-05 CN claimed
CN-114409672-B Conjugated macrocyclic material based on benzodithiophene, and preparation method and application thereof 复旦大学 2023-09-05 CN claimed
US-20230242550-A1 PROCESS FOR THE PREPARATION OF TRICYCLIC PI3K INHIBITOR COMPOUNDS AND METHODS FOR USING THE SAME FOR THE TREATMENT OF CANCER GENENTECH, INC. 2023-08-03 US claimed
EP-4161904-A1 INTERMEDIATES AND PROCESSES FOR THE PREPARATION OF TOLVAPTAN AND ITS DERIVATIVES Cambrex Profarmaco Milano S.r.l. (IT) 2023-04-12 EP claimed
EP-4746662-A1 ORGANIC ELECTRONICS MATERIAL, ORGANIC LAYER, AND ORGANIC ELECTRONICS ELEMENT Resonac Corporation (JP) 2026-05-20 EP disclosed
EP-4745179-A1 METHOD FOR PRODUCING ARYLAMINE POLYMER Resonac Corporation (JP) 2026-05-20 EP disclosed
CN-122070286-A DNA polymerase theta inhibitor and application thereof 上海湃隆生物科技有限公司 2026-05-19 CN disclosed
US-12630510-B2 EP2 antagonist ONO PHARMACEUTICAL CO., LTD. (JP) 2026-05-19 US disclosed
EP-4739669-A1 SODIUM CHANNEL BLOCKERS Novartis AG (CH) 2026-05-13 EP disclosed
CN-122010981-A GLP-1 receptor agonism/GLP-1 secretagogue double-target compound 仁奎医药科技(北京)有限公司 2026-05-12 CN disclosed
WO-2015155197-A1 NOVEL MACROCYCLIC COMPOUNDS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2015-10-15 WO disclosed
US-20150191461-A1 PYRAZOLYL DERIVATIVES AS SYK INHIBITORS MERCK SHARP & DOHME CORP. (US) 2015-07-09 US disclosed
US-20150126487-A1 HETEROCYCLIC COMPOUND AND USE THEREFOR TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-05-07 US disclosed
US-20150005279-A1 PRIMARY CARBOXAMIDES AS BTK INHIBITORS ABBVIE INC. (US) 2015-01-01 US disclosed
US-8846935-B2 Indazoles GLAXOSMITHKLINE LLC (US) 2014-09-30 US disclosed
US-20130053383-A1 INDAZOLES GLAXOSMITHKLINE LLC 2013-02-28 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 (7 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-20150191461-A1 PYRAZOLYL DERIVATIVES AS SYK INHIBITORS SYK, BTK, LCK ROCK2 135/4885EPHX2 2622/4885CYP1A2 637/4885
US-20130053383-A1 INDAZOLES IDH3A, CYP3A7, IDH3B ROCK2 1949/4885EPHX2 2881/4885CYP1A2 16/4885
US-20260125395-A1 PROCESS FOR THE PREPARATION OF TRICYCLIC PI3K INHIBITOR COMPOUNDS AND METHODS FOR USING THE SAME FOR THE TREATMENT OF CANCER PIK3C2B, PIK3C2A, PIK3CA ROCK2 321/4885EPHX2 2058/4885CYP1A2 984/4885
US-20150005279-A1 PRIMARY CARBOXAMIDES AS BTK INHIBITORS BTK, SYK, MYD88 ROCK2 1030/4885EPHX2 2368/4885CYP1A2 1415/4885
US-20230242550-A1 PROCESS FOR THE PREPARATION OF TRICYCLIC PI3K INHIBITOR COMPOUNDS AND METHODS FOR USING THE SAME FOR THE TREATMENT OF CANCER PIK3CA, PIK3CD, PIK3CB ROCK2 406/4885EPHX2 1909/4885CYP1A2 1595/4885
US-12630510-B2 EP2 antagonist PTGER2, PTGER1, PTGER4 ROCK2 536/4885EPHX2 345/4885CYP1A2 423/4885
US-20150126487-A1 HETEROCYCLIC COMPOUND AND USE THEREFOR CHRM1, CHRM4, CHRM2 ROCK2 1952/4885EPHX2 3212/4885CYP1A2 764/4885

“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.