SCHEMBL20546993

SCHEMBL20546993

COc1cc2nc[nH]c(=O)c2c(F)c1OC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 2/20 0.45
PARP1 P09874 6/20 0.42
DHFR P00374 1/20 0.42
KMT2A Q03164 1/20 0.40
PDPK1 O15530 2/20 0.36
EGFR P00533 1/20 0.36
KDM4E B2RXH2 1/20 0.36
NPC1 O15118 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CHEK1 O14757 1/20 0.36
PIM1 P11309 1/20 0.36
RPS6KA3 P51812 1/20 0.36
BRD4 O60885 2/20 0.35
PDE3B Q13370 1/20 0.35
PDE3A Q14432 1/20 0.35
TERT O14746 1/20 0.35
PDGFRB P09619 1/20 0.34

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
SCHEMBL30353891 1.00 SRC (0.45) SRCPARP1DHFRKMT2APDPK1
SCHEMBL30353903 0.86 SRC (0.48) SRCPARP1DHFRKMT2APDPK1
SCHEMBL6912846 0.86 SRC (0.48) SRCPARP1DHFRKMT2APDPK1
SCHEMBL6912439 0.82 SRC (0.45) SRCPARP1DHFRKMT2APDPK1
SCHEMBL15680657 0.79 SRC (0.42) SRCPARP1DHFRKMT2APDPK1
SCHEMBL15710544 0.79 PARP1 (0.44) SRCPARP1KMT2APDPK1EGFR
SCHEMBL21808021 0.79 PARP1 (0.51) SRCPARP1DHFRKMT2APDPK1
SCHEMBL30353912 0.79 PARP1 (0.44) SRCPARP1KMT2APDPK1EGFR
SCHEMBL1468319 0.78 TNF (0.46) SRCPARP1DHFRKMT2AALDH1A1
Hydrochloric Acid SCHEMBL28100847 0.78 PARP1 (0.43) SRCPARP1KMT2APDPK1EGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110573505-B C 5 -anilinoquinazoline compounds and their use in the treatment of cancer 阿斯利康(瑞典)有限公司 2023-04-11 CN disclosed
EP-3615522-B1 C5-ANILINOQUINAZOLINE COMPOUNDS AND THEIR USE IN TREATING CANCER ASTRAZENECA AB (SE) 2021-08-04 EP disclosed
US-10829479-B2 C5-anilinoquinazoline compounds and their use in treating cancer ASTRAZENECA AB (SE) 2020-11-10 US disclosed
EP-3615522-A1 C5-ANILINOQUINAZOLINE COMPOUNDS AND THEIR USE IN TREATING CANCER Astrazeneca (SE) 2020-03-04 EP disclosed
CN-110573505-A C5-anilinoquinazoline compounds and their use in the treatment of cancer 阿斯利康(瑞典)有限公司 2019-12-13 CN disclosed
US-20190263787-A1 C5-anilinoquinazoline Compounds and Their Use in Treating Cancer ASTRAZENECA AB (SE) 2019-08-29 US disclosed
US-10273227-B2 C5-anilinoquinazoline compounds and their use in treating cancer ASTRAZENECA AB (SE) 2019-04-30 US disclosed
WO-2018197642-A1 C5-ANILINOQUINAZOLINE COMPOUNDS AND THEIR USE IN TREATING CANCER ASTRAZENECA AB (SE) 2018-11-01 WO disclosed
US-20180312490-A1 C5-ANILINOQUINAZOLINE COMPOUNDS AND THEIR USE IN TREATING CANCER ASTRAZENECA AB (SE) 2018-11-01 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-20190263787-A1 C5-anilinoquinazoline Compounds and Their Use in Treating Cancer KIT, C5, C9 SRC 2261/4885PARP1 158/4885DHFR 2430/4885
US-20180312490-A1 C5-ANILINOQUINAZOLINE COMPOUNDS AND THEIR USE IN TREATING CANCER KIT, C5, C9 SRC 2261/4885PARP1 158/4885DHFR 2430/4885
US-10829479-B2 C5-anilinoquinazoline compounds and their use in treating cancer KIT, C5, C9 SRC 2261/4885PARP1 158/4885DHFR 2430/4885
US-10273227-B2 C5-anilinoquinazoline compounds and their use in treating cancer KIT, C5, C9 SRC 2261/4885PARP1 158/4885DHFR 2430/4885

“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.