SCHEMBL16762292

SCHEMBL16762292

Nc1c(Br)ccc2c1C(=O)CO2

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.33
KDM4E B2RXH2 2/20 0.31
GAA P10253 1/20 0.31
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
POLB P06746 1/20 0.30
MAPT P10636 1/20 0.30
HTT P42858 1/20 0.30
KMT2A Q03164 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL17397682 0.73 KDM4E (0.37) KDM4EGAAMEN1ALDH1A1MAPT
SCHEMBL8790746 0.69 ADORA2A (0.38) KDM4EGAAMAPT
SCHEMBL23635064 0.65 TXNRD1 (0.40) ALDH1A1
SCHEMBL10158539 0.65 MAPT (0.42) KDM4EGAAMEN1ALDH1A1POLB
SCHEMBL5537181 0.64 MMP12 (0.35) KDM4EGAAMAPT
SCHEMBL1429290 0.63 KDM4E (0.44) APPKDM4EGAAMEN1ALDH1A1
SCHEMBL30019143 0.63 CYP19A1 (0.53) KDM4EGAAALDH1A1MAPTHTT
SCHEMBL30954241 0.63 PSMB5 (0.33)
SCHEMBL21236396 0.63 USP8 (0.36) KDM4EGAAMEN1KMT2A
SCHEMBL5537188 0.63 KDM4E (0.41) KDM4EGAAMEN1ALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2881397-B1 COMPOUND AND PHARMACEUTICAL COMPOSITION FOR NEUROPSYCHOLOGICAL DISORDER OR MALIGNANT TUMOR UNIV KYOTO (JP) 2020-09-02 EP disclosed
EP-2881397-B1 COMPOUND AND PHARMACEUTICAL COMPOSITION FOR NEUROPSYCHOLOGICAL DISORDER OR MALIGNANT TUMOR UNIV KYOTO (JP) 2020-09-02 EP disclosed
CN-106986865-B Compound and pharmaceutical composition for mental and neurological diseases or malignant tumors 国立大学法人京都大学 2020-02-28 CN disclosed
US-10017524-B2 Compound and pharmaceutical composition for neuropsychological disorder or malignant tumor KYOTO UNIVERSITY (JP) 2018-07-10 US disclosed
US-10017524-B2 Compound and pharmaceutical composition for neuropsychological disorder or malignant tumor KYOTO UNIVERSITY (JP) 2018-07-10 US disclosed
US-10017524-B2 Compound and pharmaceutical composition for neuropsychological disorder or malignant tumor KYOTO UNIVERSITY (JP) 2018-07-10 US disclosed
US-20170355715-A1 COMPOUND AND PHARMACEUTICAL COMPOSITION FOR NEUROPSYCHOLOGICAL DISORDER OR MALIGNANT TUMOR KYOTO UNIVERSITY (JP) 2017-12-14 US disclosed
US-20170355715-A1 COMPOUND AND PHARMACEUTICAL COMPOSITION FOR NEUROPSYCHOLOGICAL DISORDER OR MALIGNANT TUMOR KYOTO UNIVERSITY (JP) 2017-12-14 US disclosed
US-20170355715-A1 COMPOUND AND PHARMACEUTICAL COMPOSITION FOR NEUROPSYCHOLOGICAL DISORDER OR MALIGNANT TUMOR KYOTO UNIVERSITY (JP) 2017-12-14 US disclosed
US-9745323-B2 Compound and pharmaceutical composition for neuropsychological disorder or malignant tumor KYOTO UNIVERSITY (JP) 2017-08-29 US disclosed
US-20160303089-A1 COMPOUND PERTAINING TO NEUROPOIESIS AND DRUG COMPOSITION KYOTO UNIVERSITY (JP) 2016-10-20 US disclosed
US-20160303089-A1 COMPOUND PERTAINING TO NEUROPOIESIS AND DRUG COMPOSITION KYOTO UNIVERSITY (JP) 2016-10-20 US disclosed
US-20160303089-A1 COMPOUND PERTAINING TO NEUROPOIESIS AND DRUG COMPOSITION KYOTO UNIVERSITY (JP) 2016-10-20 US disclosed
US-20150225421-A1 COMPOUND AND PHARMACEUTICAL COMPOSITION FOR NEUROPSYCHOLOGICAL DISORDER OR MALIGNANT TUMOR KYOTO UNIVERSITY (JP) 2015-08-13 US disclosed
US-20150225421-A1 COMPOUND AND PHARMACEUTICAL COMPOSITION FOR NEUROPSYCHOLOGICAL DISORDER OR MALIGNANT TUMOR KYOTO UNIVERSITY (JP) 2015-08-13 US disclosed
US-20150225421-A1 COMPOUND AND PHARMACEUTICAL COMPOSITION FOR NEUROPSYCHOLOGICAL DISORDER OR MALIGNANT TUMOR KYOTO UNIVERSITY (JP) 2015-08-13 US disclosed
WO-2015083750-A1 COMPOUND PERTAINING TO NEUROPOIESIS AND DRUG COMPOSITION 国立大学法人京都大学 2015-06-11 WO disclosed
EP-2881397-A1 COMPOUND AND PHARMACEUTICAL COMPOSITION FOR NEUROPSYCHOLOGICAL DISORDER OR MALIGNANT TUMOR Kyoto University (JP) 2015-06-10 EP disclosed
EP-2881397-A1 COMPOUND AND PHARMACEUTICAL COMPOSITION FOR NEUROPSYCHOLOGICAL DISORDER OR MALIGNANT TUMOR Kyoto University (JP) 2015-06-10 EP disclosed
CN-104520303-A Compound and pharmaceutical composition for mental and neurological diseases or malignant tumors NAT UNIV CORP KYOTO UNIV 2015-04-15 CN 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-20150225421-A1 COMPOUND AND PHARMACEUTICAL COMPOSITION FOR NEUROPSYCHOLOGICAL DISORDER OR MALIGNANT TUMOR VHL, TP53, COMT APP 17/4885KDM4E 2440/4885GAA 208/4885
US-20170355715-A1 COMPOUND AND PHARMACEUTICAL COMPOSITION FOR NEUROPSYCHOLOGICAL DISORDER OR MALIGNANT TUMOR VHL, TP53, COMT APP 17/4885KDM4E 2440/4885GAA 208/4885
US-20160303089-A1 COMPOUND PERTAINING TO NEUROPOIESIS AND DRUG COMPOSITION BDNF, DCX, NTRK2 APP 463/4885KDM4E 1643/4885GAA 1355/4885
US-10017524-B2 Compound and pharmaceutical composition for neuropsychological disorder or malignant tumor VHL, TP53, COMT APP 17/4885KDM4E 2440/4885GAA 208/4885

“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.