SCHEMBL968557

SCHEMBL968557

CC(C)Oc1cc(F)ccc1N

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.45
TLR8 Q9NR97 1/20 0.39
MCHR1 Q99705 1/20 0.39
IRAK4 Q9NWZ3 1/20 0.38
KEAP1 Q14145 1/20 0.37
ALOX5AP P20292 1/20 0.37
FEN1 P39748 1/20 0.37
EP300 Q09472 1/20 0.36
TDP1 Q9NUW8 2/20 0.36
CYP3A4 P08684 1/20 0.36
TSHR P16473 1/20 0.36
HSD17B10 Q99714 1/20 0.36
POLB P06746 1/20 0.36
KCNH2 Q12809 2/20 0.36
TMEM97 Q5BJF2 2/20 0.36
SIGMAR1 Q99720 2/20 0.36
CSNK2A1 P68400 2/20 0.36
HASPIN Q8TF76 1/20 0.36
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35

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
SCHEMBL30658533 1.00 ALDH1A1 (0.45) ALDH1A1TLR8MCHR1IRAK4KEAP1
Hydrochloric Acid SCHEMBL15534313 0.98 ALDH1A1 (0.43) ALDH1A1TLR8MCHR1IRAK4KEAP1
SCHEMBL23033967 0.85 ALDH1A1 (0.42) ALDH1A1KEAP1TDP1CYP3A4TSHR
SCHEMBL1136306 0.84 POLB (0.46) ALDH1A1TLR8MCHR1IRAK4ALOX5AP
SCHEMBL16338412 0.82 ALDH1A1 (0.39) ALDH1A1KEAP1MKNK1MKNK2
SCHEMBL16335648 0.82 ALDH1A1 (0.39) ALDH1A1KEAP1TDP1CYP3A4TSHR
SCHEMBL16362682 0.82 ALDH1A1 (0.39) ALDH1A1KEAP1MKNK1MKNK2
SCHEMBL2313110 0.82 ALDH1A1 (0.46) ALDH1A1KEAP1TDP1CYP3A4TSHR
SCHEMBL9070294 0.79 ALDH1A1 (0.59) ALDH1A1TLR8MCHR1IRAK4EP300
SCHEMBL7519140 0.79 ALDH1A1 (0.44) ALDH1A1TLR8MCHR1IRAK4EP300

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12545654-B2 MYC inhibitors and uses thereof STEMSYNERGY THERAPEUTICS, INC. (US) 2026-02-10 US disclosed
EP-4647127-A2 COMPOUNDS FOR THE TREATMENT OF KINASE-DEPENDENT DISORDERS Exelixis, Inc. (US) 2025-11-12 EP disclosed
EP-3743070-B1 COMPOUNDS FOR THE TREATMENT OF KINASE-DEPENDENT DISORDERS EXELIXIS INC (US) 2025-07-23 EP disclosed
CN-118056816-A Pyrazole-3-ketone derivative, and preparation method and application thereof 沈阳药科大学 2024-05-21 CN disclosed
EP-3939981-B1 FUSED THIAZOLOPYRIMIDINE DERIVATIVES AS MNKS INHIBITORS LIFEARC (GB) 2024-04-03 EP disclosed
US-20240043414-A1 Compounds for the Treatment of Kinase-Dependent Disorders EXELIXIS, INC. 2024-02-08 US disclosed
EP-3792264-B1 PYRROPYRIMIDINE COMPOUNDS AS MNKS INHIBITORS LIFEARC (GB) 2024-01-03 EP disclosed
CN-108368114-B Pyrrolopyrimidine compounds as MNK inhibitors 生命弧度公司 2023-10-24 CN disclosed
CN-111757735-B Compounds for the treatment of kinase dependent disorders 埃克塞里艾克西斯公司 2023-09-22 CN disclosed
US-20230150956-A1 MYC INHIBITORS AND USES THEREOF STEMSYNERGY THERAPEUTICS, INC. 2023-05-18 US disclosed
US-20110015193-A1 1, 5-DIHYDRO-PYRAZOLO (3, 4-D) PYRIMIDIN-4-ONE DERIVATIVES AND THEIR USE AS PDE9A MUDULATORS FOR THE TREATMENT OF CNS DISORDERS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-01-20 US disclosed
US-20100311749-A1 4-BENZOYL-1-SUBSTITUTED-PIPERAZIN-2-ONE DERIVATIVES AS P2X7 MODULATORS GLAXO GROUP LIMITED (GB) 2010-12-09 US disclosed
EP-2212300-A1 4-BENZ0YL-1-SUBSTITUTED-PIPERAZIN-2-0NE DERIVATIVES AS P2X7 MODULATORS Glaxo Group Limited (GB) 2010-08-04 EP disclosed
WO-2009053459-A1 4-BENZ0YL-1-SUBSTITUTED-PIPERAZIN-2-0NE DERIVATIVES AS P2X7 MODULATORS GLAXO GROUP LIMITED (GB) 2009-04-30 WO disclosed
US-20060167014-A1 Piperazine compounds and medicinal use thereof MITSUBISHI PHARMA CORPORATION 2006-07-27 US disclosed
EP-1029851-B1 PIPERAZINE COMPOUNDS AND MEDICINAL USE THEREOF MITSUBISHI PHARMA CORP (JP) 2005-04-20 EP disclosed
US-20030055064-A1 Piperazine compounds and medicinal use thereof MITSUBISHI PHARMA CORPORATION 2003-03-20 US disclosed
US-20030018034-A1 Piperazine compounds and medicinal use thereof MITSUBISHI PHARMA CORPORATION 2003-01-23 US disclosed
US-6455528-B1 TUMOR NECROSIS FACTOR ANTAGONIST AND/OR INTERLEUKIN PROMOTER; ANTIALLERGENS, ANTIINFLAMMATORY AGENTS; AUTOIMMUNE DISEASE TREATMENT MITSUBISHI PHARMA CORPORATION (JP) 2002-09-24 US disclosed
EP-1029851-A1 PIPERAZINE COMPOUNDS AND MEDICINAL USE THEREOF YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 2000-08-23 EP 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 (8 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-20230150956-A1 MYC INHIBITORS AND USES THEREOF MYC, AURKA, AURKC ALDH1A1 4332/4885TLR8 4402/4885MCHR1 3906/4885
US-20110015193-A1 1, 5-DIHYDRO-PYRAZOLO (3, 4-D) PYRIMIDIN-4-ONE DERIVATIVES AND THEIR USE AS PDE9A MUDULATORS FOR THE TREATMENT OF CNS DISORDERS PDE9A, PDE7A, PDE1C ALDH1A1 127/4885TLR8 2435/4885MCHR1 1075/4885
US-20030055064-A1 Piperazine compounds and medicinal use thereof TNF, IL5, CCR10 ALDH1A1 710/4885TLR8 598/4885MCHR1 3504/4885
US-20030018034-A1 Piperazine compounds and medicinal use thereof TNF, IL5, CCR10 ALDH1A1 788/4885TLR8 435/4885MCHR1 3612/4885
US-20060167014-A1 Piperazine compounds and medicinal use thereof TNF, CCR10, RELA ALDH1A1 1148/4885TLR8 502/4885MCHR1 3196/4885
US-20100311749-A1 4-BENZOYL-1-SUBSTITUTED-PIPERAZIN-2-ONE DERIVATIVES AS P2X7 MODULATORS P2RX7, P2RX3, P2RX2 ALDH1A1 3763/4885TLR8 230/4885MCHR1 227/4885
US-12545654-B2 MYC inhibitors and uses thereof MYC, MYCBP, NR2E1 ALDH1A1 4317/4885TLR8 4001/4885MCHR1 1853/4885
US-20240043414-A1 Compounds for the Treatment of Kinase-Dependent Disorders ERBB2, MAP3K6, MAP3K1 ALDH1A1 3310/4885TLR8 2175/4885MCHR1 2651/4885

“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.