SCHEMBL19249161

SCHEMBL19249161

C=C(O)c1cc(C)cc(Br)c1N

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.41
MYC P01106 1/20 0.38
MAPT P10636 2/20 0.34
GAA P10253 1/20 0.34
ALDH1A1 P00352 3/20 0.32
TSHR P16473 1/20 0.32
NPC1 O15118 1/20 0.31
MAPK1 P28482 1/20 0.31
HTT P42858 1/20 0.31
PLAU P00749 2/20 0.31
F2 P00734 1/20 0.31
F10 P00742 1/20 0.31
PLG P00747 1/20 0.31
PLAT P00750 1/20 0.31

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
SCHEMBL698960 0.80 KDM4E (0.66) KDM4EMYCMAPTGAAALDH1A1
SCHEMBL19705660 0.76 GAA (0.34) MAPTGAA
SCHEMBL22674780 0.76 GAA (0.34) MAPTGAA
SCHEMBL25360449 0.76 KDM4E (0.46) KDM4EMYCMAPTGAAALDH1A1
SCHEMBL2379171 0.76 KDM4E (0.46) KDM4EMYCMAPTGAAALDH1A1
SCHEMBL31481672 0.76 KDM4E (0.46) KDM4EMYCMAPTGAAALDH1A1
SCHEMBL348577 0.75 MAPT (0.58) KDM4EMAPTGAAALDH1A1TSHR
SCHEMBL6560116 0.73 MAPT (0.55) KDM4EMAPTGAAALDH1A1TSHR
SCHEMBL19705808 0.72 KDM4E (0.41) KDM4EMAPTALDH1A1TSHRMAPK1
SCHEMBL25170294 0.72 KDM4E (0.42) KDM4EMYCMAPTALDH1A1NPC1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200360383-A1 Quinazoline Compounds GILEAD SCIENCES, INC. 2020-11-19 US disclosed
US-10548898-B2 Quinazoline compounds GILEAD SCIENCES INC. (US) 2020-02-04 US disclosed
US-20190134035-A1 Quinazoline Compounds GILEAD SCIENCES, INC. 2019-05-09 US disclosed
US-10206926-B2 Quinazoline compounds GILEAD SCIENCES, INC. (US) 2019-02-19 US disclosed
US-20170354656-A1 Quinazoline Compounds INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY OF THE AS CR, V.V.I. (CZ) 2017-12-14 US disclosed
US-9730936-B2 Quinazoline compounds GILEAD SCIENCES, INC. (US) 2017-08-15 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 (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-20190134035-A1 Quinazoline Compounds TTBK1, TTBK2, MAPT KDM4E 4154/4885MYC 3345/4885MAPT 3/4885
US-10206926-B2 Quinazoline compounds TTBK1, TTBK2, MAPT KDM4E 4154/4885MYC 3345/4885MAPT 3/4885
US-20200360383-A1 Quinazoline Compounds TTBK1, TTBK2, MAPT KDM4E 4154/4885MYC 3345/4885MAPT 3/4885
US-10548898-B2 Quinazoline compounds TTBK1, TTBK2, MAPT KDM4E 4154/4885MYC 3345/4885MAPT 3/4885
US-20170354656-A1 Quinazoline Compounds TTBK1, TTBK2, MAPT KDM4E 4154/4885MYC 3345/4885MAPT 3/4885

“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.