SCHEMBL1783378

SCHEMBL1783378

CC(=O)/C=C/CCC(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.33
PPARD Q03181 1/20 0.33
PPARA Q07869 1/20 0.33
ACLY P53396 1/20 0.33
CNR1 P21554 3/20 0.33
CNR2 P34972 3/20 0.33
TRPA1 O75762 1/20 0.33
TRPV1 Q8NER1 1/20 0.33
GLA P06280 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
TBXAS1 P24557 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
SCHEMBL1783379 1.00 PPARG (0.33) PPARGPPARDPPARAACLYCNR1
SCHEMBL11765706 0.77 PPARG (0.36) PPARGPPARDPPARAACLYTDP1
SCHEMBL11765710 0.77 PPARG (0.36) PPARGPPARDPPARAACLYTDP1
SCHEMBL18431484 0.76 ALOX15 (0.30)
SCHEMBL13433290 0.76 HCAR2 (0.48)
SCHEMBL11708968 0.75 ALDH1A1 (0.30)
SCHEMBL11708970 0.75 ALDH1A1 (0.30)
SCHEMBL30496490 0.74 ALDH1A1 (0.49) PPARGPPARDPPARACNR1CNR2
SCHEMBL21689936 0.73 MAPT (0.41)
SCHEMBL12710484 0.73 MAPT (0.58) TRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240016811-A1 CANCER THERAPY USING A COMBINATION OF CDK7 INHIBITOR WITH AN ANTI-MICROTUBULE AGENT AURIGENE ONCOLOGY LIMITED (IN) 2024-01-18 US disclosed
US-20230265057-A1 INHIBITORS OF PARG ARASE THERAPEUTICS INC. 2023-08-24 US disclosed
US-20230250062-A9 Substituted Heterocyclyl Derivatives as CDK Inhibitors AURIGENE ONCOLOGY LIMITED (IN) 2023-08-10 US disclosed
US-20180155293-A1 Substituted Heterocyclyl Derivatives as CDK Inhibitors AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2018-06-07 US disclosed
US-20150031106-A1 HCV PROTEASE INHIBITORS AND USES THEREOF CELGENE AVILOMICS RESEARCH, INC. (US) 2015-01-29 US disclosed
US-8741837-B2 HCV protease inhibitors and uses thereof CELGENE AVILOMICS RESEARCH, INC. (US) 2014-06-03 US disclosed
US-8632792-B2 Cooling sensation agent composition and sensory stimulation agent composition TAKASAGO INTERNATIONAL CORPORATION (JP) 2014-01-21 US disclosed
US-20130017991-A1 HCV PROTEASE INHIBITORS AND USES THEREOF CELGENE AVILOMICS RESEARCH, INC. (US) 2013-01-17 US disclosed
US-8293705-B2 HCV protease inhibitors and uses thereof AVILA THERAPEUTICS, INC. (US) 2012-10-23 US disclosed
US-20110117147-A1 COOLING SENSATION AGENT COMPOSITION AND SENSORY STIMULATION AGENT COMPOSITION TAKASAGO INTERNATIONAL CORPORATION (JP) 2011-05-19 US disclosed
WO-2009123355-A2 COOLING SENSATION AGENT COMPOSITION AND SENSORY STIMULATION AGENT COMPOSITION TAKASAGO INTERNATIONAL CORPORATION (JP) 2009-10-08 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 (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-20230250062-A9 Substituted Heterocyclyl Derivatives as CDK Inhibitors CDK19, CDK9, CDK1 PPARG 2753/4885PPARD 2402/4885PPARA 3401/4885
US-20240016811-A1 CANCER THERAPY USING A COMBINATION OF CDK7 INHIBITOR WITH AN ANTI-MICROTUBULE AGENT CDK7, CDK17, HDAC7 PPARG 2748/4885PPARD 3527/4885PPARA 3350/4885
US-20110117147-A1 COOLING SENSATION AGENT COMPOSITION AND SENSORY STIMULATION AGENT COMPOSITION TRPA1, HRH1, HRH2 PPARG 1977/4885PPARD 2480/4885PPARA 1799/4885
US-20230265057-A1 INHIBITORS OF PARG PARG, PARN, PLG PPARG 1003/4885PPARD 1266/4885PPARA 1678/4885
US-20180155293-A1 Substituted Heterocyclyl Derivatives as CDK Inhibitors CDK19, CDK17, CDK1 PPARG 2764/4885PPARD 2542/4885PPARA 3497/4885
US-20150031106-A1 HCV PROTEASE INHIBITORS AND USES THEREOF PEPD, CTRL, CTSC PPARG 2681/4885PPARD 1459/4885PPARA 1829/4885
US-20130017991-A1 HCV PROTEASE INHIBITORS AND USES THEREOF PEPD, CTRL, CTSC PPARG 2681/4885PPARD 1459/4885PPARA 1829/4885

“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.