SCHEMBL16593256

SCHEMBL16593256

Cc1ccnc2c(I)cn(C(=O)OC(C)(C)C)c12

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.34
BCHE P06276 1/20 0.33
GABRG2 P18507 1/20 0.33
GABRB3 P28472 1/20 0.33
GABRA5 P31644 1/20 0.33
POLB P06746 1/20 0.33
TNK2 Q07912 1/20 0.32
GPR119 Q8TDV5 7/20 0.32
BUB1 O43683 1/20 0.32
HSP90AA1 P07900 1/20 0.31
HSP90AB1 P08238 1/20 0.31
SCN9A Q15858 1/20 0.31
SCN3A Q9NY46 1/20 0.31
HTR6 P50406 1/20 0.31
ACHE P22303 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
SCHEMBL21042589 0.88 L3MBTL1 (0.36) L3MBTL1BCHEPOLBTNK2GPR119
SCHEMBL16606149 0.86 POLB (0.37) L3MBTL1BCHEGABRG2GABRB3GABRA5
SCHEMBL16606153 0.85 CFTR (0.37) BCHEGABRG2GABRB3GABRA5POLB
SCHEMBL16606151 0.83 GPR119 (0.37) GPR119
SCHEMBL16593422 0.82 CCR1 (0.36) L3MBTL1
SCHEMBL10072162 0.79 GPR119 (0.35) L3MBTL1BCHEGABRG2GABRB3GABRA5
SCHEMBL16593587 0.78 L3MBTL1 (0.43) L3MBTL1BCHEGABRG2GABRB3GABRA5
SCHEMBL17179359 0.76 L3MBTL1 (0.43) L3MBTL1BCHEGPR119BUB1HSP90AA1
SCHEMBL14605052 0.75 POLB (0.42) L3MBTL1BCHEGABRG2GABRB3GABRA5
SCHEMBL31751884 0.74 BCHE (0.35) L3MBTL1BCHEGABRG2GABRB3GABRA5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3489237-B1 4-AZAINDOLE DERIVATIVES EISAI R&D MAN CO LTD (JP) 2020-05-13 EP disclosed
EP-3489237-B1 4-AZAINDOLE DERIVATIVES EISAI R&D MAN CO LTD (JP) 2020-05-13 EP disclosed
EP-3489237-A1 4-AZAINDOLE DERIVATIVES Eisai R&D Management Co., Ltd. (JP) 2019-05-29 EP disclosed
EP-3489237-A1 4-AZAINDOLE DERIVATIVES Eisai R&D Management Co., Ltd. (JP) 2019-05-29 EP disclosed
EP-3052496-B1 4-AZAINDOLE DERIVATIVES EISAI R&D MAN CO LTD (JP) 2018-11-28 EP disclosed
US-10072005-B2 4-azaindole derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2018-09-11 US disclosed
US-20180208593-A1 4-Azaindole Derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2018-07-26 US disclosed
US-20180208593-A1 4-Azaindole Derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2018-07-26 US disclosed
US-20180208593-A1 4-Azaindole Derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2018-07-26 US disclosed
US-9926312-B2 4-azaindole derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2018-03-27 US disclosed
US-9926312-B2 4-azaindole derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2018-03-27 US disclosed
US-20160244445-A1 4-Azaindole Derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2016-08-25 US disclosed
US-20160244445-A1 4-Azaindole Derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2016-08-25 US disclosed
US-20160244445-A1 4-Azaindole Derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2016-08-25 US disclosed
EP-3052496-A1 4-AZAINDOLE DERIVATIVES Eisai R&D Management Co., Ltd. (JP) 2016-08-10 EP disclosed
WO-2015049574-A1 4-AZAINDOLE DERIVATIVES EISAI R&D MANAGEMENT CO., LTD. (JP) 2015-04-09 WO disclosed
WO-2015049574-A1 4-AZAINDOLE DERIVATIVES EISAI R&D MANAGEMENT CO., LTD. (JP) 2015-04-09 WO disclosed
US-20150094328-A1 4-Azaindole Derivatives EISAI R&D MAN CO LTD (JP) 2015-04-02 US disclosed
US-20150094328-A1 4-Azaindole Derivatives EISAI R&D MAN CO LTD (JP) 2015-04-02 US disclosed
US-20150094328-A1 4-Azaindole Derivatives EISAI R&D MAN CO LTD (JP) 2015-04-02 US 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-10072005-B2 4-azaindole derivatives CHRM1, CHRM4, CHRM2 L3MBTL1 1762/4885BCHE 29/4885GABRG2 501/4885
US-20160244445-A1 4-Azaindole Derivatives CHRM1, CHRM4, CHRM2 L3MBTL1 1762/4885BCHE 29/4885GABRG2 501/4885
US-20180208593-A1 4-Azaindole Derivatives CHRM1, CHRM4, CHRM2 L3MBTL1 1762/4885BCHE 29/4885GABRG2 501/4885
US-20150094328-A1 4-Azaindole Derivatives CHRM1, CHRM4, CHRM2 L3MBTL1 1762/4885BCHE 29/4885GABRG2 501/4885

“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.