SCHEMBL15054866

SCHEMBL15054866

CCC(C)(C)c1ccc(Oc2ccc([N+](=O)[O-])cc2F)cc1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HSPB1 P04792 6/20 0.58
ALDH1A1 P00352 3/20 0.44
MAPT P10636 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
PDE7A Q13946 1/20 0.43
TBXA2R P21731 3/20 0.43
S1PR4 O95977 1/20 0.43
RRM1 P23921 1/20 0.43
GAA P10253 1/20 0.42
THRB P10828 1/20 0.42
HTT P42858 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL15055667 0.87 HSPB1 (0.63) HSPB1ALDH1A1MAPTMEN1KMT2A
SCHEMBL15055286 0.82 NPC1 (0.58) HSPB1ALDH1A1MAPTMEN1KMT2A
SCHEMBL27859313 0.82 HSPB1 (0.82) HSPB1ALDH1A1MAPTMEN1KMT2A
SCHEMBL24091750 0.82 HSPB1 (0.51) HSPB1ALDH1A1MAPTMEN1KMT2A
SCHEMBL8493441 0.81 HSPB1 (0.56) HSPB1ALDH1A1MAPTMEN1KMT2A
SCHEMBL31287841 0.80 HSPB1 (0.82) HSPB1ALDH1A1MAPTMEN1KMT2A
SCHEMBL16216736 0.79 RAB9A (0.50) HSPB1MAPTMEN1KMT2ANPC1
SCHEMBL15054858 0.78 RAB9A (0.65) HSPB1ALDH1A1MAPTNPC1RAB9A
SCHEMBL31225194 0.78 RAB9A (0.65) HSPB1ALDH1A1MAPTNPC1RAB9A
SCHEMBL22069708 0.77 HSPB1 (0.68) HSPB1ALDH1A1MAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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
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 disclosed
US-11085918-B2 Method for identifying modulators of notch signaling ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2021-08-10 US disclosed
US-11085918-B2 Method for identifying modulators of notch signaling ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2021-08-10 US disclosed
CN-107434779-B Notch signaling pathway inhibitors and their use in cancer treatment 洛桑联邦理工学院(EPFL) 2021-07-13 CN disclosed
US-20190219566-A1 METHOD FOR IDENTIFYING MODULATORS OF NOTCH SIGNALING ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2019-07-18 US disclosed
US-20190219566-A1 METHOD FOR IDENTIFYING MODULATORS OF NOTCH SIGNALING ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2019-07-18 US disclosed
US-10274481-B2 Method for identifying modulators of notch signaling ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2019-04-30 US disclosed
US-20160266095-A1 INHIBITORS OF NOTCH SIGNALLING PATHWAY AND USE THEREOF IN TREATMENT OF CANCERS ECOLE POLYTECHNIQUE FED DE LAUSANNE (EPFL) (CH) 2016-09-15 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-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 (5 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-10274481-B2 Method for identifying modulators of notch signaling NOTCH3, NOTCH1, NOTCH4 HSPB1 4691/4885ALDH1A1 3224/4885MAPT 3343/4885
US-20210382038-A1 METHOD FOR IDENTIFYING MODULATORS OF NOTCH SIGNALING NOTCH3, NOTCH1, NOTCH4 HSPB1 4691/4885ALDH1A1 3224/4885MAPT 3343/4885
US-20190219566-A1 METHOD FOR IDENTIFYING MODULATORS OF NOTCH SIGNALING NOTCH3, NOTCH1, NOTCH4 HSPB1 4691/4885ALDH1A1 3224/4885MAPT 3343/4885
US-11085918-B2 Method for identifying modulators of notch signaling NOTCH3, NOTCH1, NOTCH4 HSPB1 4691/4885ALDH1A1 3224/4885MAPT 3343/4885
US-20140329867-A1 INHIBITORS OF NOTCH SIGNALLING PATHWAY AND USE THEREOF IN TREATMENT OF CANCERS NOTCH3, NOTCH1, NOTCH4 HSPB1 4548/4885ALDH1A1 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.