SCHEMBL15054852

SCHEMBL15054852

CC(C)(C)c1ccc(Oc2ccc(N)cc2F)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.61
ALDH1A1 P00352 4/20 0.61
MAPT P10636 3/20 0.61
NPC1 O15118 3/20 0.61
HPGD P15428 2/20 0.61
MAPK1 P28482 1/20 0.61
KDM4E B2RXH2 1/20 0.49
POLB P06746 1/20 0.49
L3MBTL1 Q9Y468 2/20 0.44
LMNA P02545 1/20 0.41
ATM Q13315 1/20 0.41
FGFR2 P21802 2/20 0.39
NPSR1 Q6W5P4 1/20 0.39
HSPB1 P04792 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
ICAM1 P05362 1/20 0.37
SELE P16581 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL8762373 0.90 MAPT (0.47) RAB9AALDH1A1MAPTNPC1HPGD
SCHEMBL8490127 0.90 MAPT (0.47) RAB9AALDH1A1MAPTNPC1HPGD
SCHEMBL16492373 0.90 MAPT (0.47) RAB9AALDH1A1MAPTNPC1HPGD
SCHEMBL8762102 0.88 MAPT (0.53) RAB9AALDH1A1MAPTNPC1HPGD
SCHEMBL8543828 0.85 SMN1; SMN2 (0.46) RAB9AALDH1A1MAPTNPC1HPGD
SCHEMBL15054858 0.85 RAB9A (0.65) RAB9AALDH1A1MAPTNPC1HPGD
SCHEMBL31225194 0.85 RAB9A (0.65) RAB9AALDH1A1MAPTNPC1HPGD
SCHEMBL21104547 0.84 ALDH1A1 (0.52) RAB9AALDH1A1MAPTNPC1HPGD
SCHEMBL1855537 0.84 MAPT (0.41) RAB9AALDH1A1MAPTNPC1HPGD
SCHEMBL12937226 0.83 HSPB1 (0.54) RAB9AALDH1A1MAPTNPC1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113616648-A Notch signaling pathway inhibitors and their use in cancer treatment 洛桑联邦理工学院(EPFL) 2021-11-09 CN claimed
US-20190219566-A1 METHOD FOR IDENTIFYING MODULATORS OF NOTCH SIGNALING ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2019-07-18 US claimed
EP-3332783-A1 INHIBITORS OF NOTCH SIGNALLING PATHWAY AND USE THEREOF IN TREATMENT OF CANCERS Ecole Polytechnique Fédérale de Lausanne (EPFL) (CH) 2018-06-13 EP claimed
EP-2793884-B1 INHIBITORS OF NOTCH SIGNALLING PATHWAY AND USE THEREOF IN TREATMENT OF CANCERS ECOLE POLYTECHNIQUE FED LAUSANNE EPFL (CH) 2017-11-29 EP claimed
US-9296682-B2 Inhibitors of notch signalling pathway and use thereof in treatment of cancers ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2016-03-29 US claimed
EP-3332783-B1 INHIBITORS OF NOTCH SIGNALLING PATHWAY AND USE THEREOF IN TREATMENT OF CANCERS ECOLE POLYTECHNIQUE FED LAUSANNE EPFL (CH) 2024-12-04 EP disclosed
CN-119019324-A Process for preparing aminodiaryl ethers and aminodiaryl ether hydrochlorides 塞莱斯蒂亚生物技术股份公司 2024-11-26 CN disclosed
US-20220185793-A1 COMPOUNDS FOR THE TREATMENT OF ONCOVIRUS INDUCED CANCER AND METHODS OF USE THEREOF CELLESTIA BIOTECH AG (CH) 2022-06-16 US disclosed
EP-3952997-A1 COMPOUNDS FOR THE TREATMENT OF ONCOVIRUS INDUCED CANCER AND METHODS OF USE THEREOF Cellestia Biotech AG (CH) 2022-02-16 EP disclosed
CN-114007696-A Compounds for treating oncovirus-induced cancer and methods of use thereof 塞莱斯蒂亚生物技术股份公司 2022-02-01 CN disclosed
US-20210382038-A1 METHOD FOR IDENTIFYING MODULATORS OF NOTCH SIGNALING ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2021-12-09 US disclosed
US-20210382038-A1 METHOD FOR IDENTIFYING MODULATORS OF NOTCH SIGNALING ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2021-12-09 US disclosed
US-9296682-B2 Inhibitors of notch signalling pathway and use thereof in treatment of cancers ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2016-03-29 US disclosed
US-9296682-B2 Inhibitors of notch signalling pathway and use thereof in treatment of cancers ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2016-03-29 US disclosed
US-20140329867-A1 INHIBITORS OF NOTCH SIGNALLING PATHWAY AND USE THEREOF IN TREATMENT OF CANCERS ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (CH) 2014-11-06 US disclosed
US-20140329867-A1 INHIBITORS OF NOTCH SIGNALLING PATHWAY AND USE THEREOF IN TREATMENT OF CANCERS ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (CH) 2014-11-06 US disclosed
US-20140329867-A1 INHIBITORS OF NOTCH SIGNALLING PATHWAY AND USE THEREOF IN TREATMENT OF CANCERS ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (CH) 2014-11-06 US disclosed
EP-2793884-A1 INHIBITORS OF NOTCH SIGNALLING PATHWAY AND USE THEREOF IN TREATMENT OF CANCERS Ecole Polytechnique Federale de Lausanne (EPFL) (CH) 2014-10-29 EP disclosed
WO-2013093885-A1 INHIBITORS OF NOTCH SIGNALLING PATHWAY AND USE THEREOF IN TREATMENT OF CANCERS Ecole polytechnique fédérale de Lausanne (EPFL) (CH) 2013-06-27 WO disclosed
WO-2013093885-A1 INHIBITORS OF NOTCH SIGNALLING PATHWAY AND USE THEREOF IN TREATMENT OF CANCERS Ecole polytechnique fédérale de Lausanne (EPFL) (CH) 2013-06-27 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 (4 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-20210382038-A1 METHOD FOR IDENTIFYING MODULATORS OF NOTCH SIGNALING NOTCH3, NOTCH1, NOTCH4 RAB9A 3388/4885ALDH1A1 3224/4885MAPT 3343/4885
US-20190219566-A1 METHOD FOR IDENTIFYING MODULATORS OF NOTCH SIGNALING NOTCH3, NOTCH1, NOTCH4 RAB9A 3388/4885ALDH1A1 3224/4885MAPT 3343/4885
US-20220185793-A1 COMPOUNDS FOR THE TREATMENT OF ONCOVIRUS INDUCED CANCER AND METHODS OF USE THEREOF TP53, HAVCR2, AQP1 RAB9A 398/4885ALDH1A1 819/4885MAPT 2780/4885
US-20140329867-A1 INHIBITORS OF NOTCH SIGNALLING PATHWAY AND USE THEREOF IN TREATMENT OF CANCERS NOTCH3, NOTCH1, NOTCH4 RAB9A 3103/4885ALDH1A1 2582/4885MAPT 3407/4885

“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.