SCHEMBL21776508

SCHEMBL21776508

CC(C)n1cc(C(N)=O)c(=O)c(-c2ccc(F)cc2)c1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AXL P30530 6/20 0.51
MET P08581 4/20 0.51
MERTK Q12866 4/20 0.39
TYRO3 Q06418 3/20 0.39
IKBKB O14920 2/20 0.39
CHUK O15111 2/20 0.39
TGFBR1 P36897 3/20 0.38
TGFBR2 P37173 1/20 0.38
SLC6A4 P31645 1/20 0.38
SLC6A3 Q01959 1/20 0.38
CDC25A P30304 1/20 0.38
CDC25C P30307 1/20 0.38
GRM2 Q14416 2/20 0.36
PTGS1 P23219 1/20 0.36
ABCB1 P08183 1/20 0.36

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
Hydrochloric Acid SCHEMBL29812561 0.99 AXL (0.50) AXLMETMERTKTYRO3IKBKB
SCHEMBL15334264 0.87 AXL (0.49) AXLMETMERTKTYRO3SLC6A4
SCHEMBL23882496 0.83 AXL (0.48) AXLMETMERTKTYRO3SLC6A4
SCHEMBL15328107 0.81 MET (0.50) AXLMETIKBKBCHUKSLC6A4
SCHEMBL15334268 0.81 KDM4E (0.49) AXLMET
SCHEMBL30672130 0.81 MERTK (0.45) AXLMETMERTKTYRO3
SCHEMBL29812460 0.80 IKBKB (0.42) AXLMETIKBKBCHUKSLC6A4
SCHEMBL29626199 0.78 MKNK1 (0.48) MERTK
SCHEMBL29812235 0.78 AXL (0.42) AXLMETMERTKTYRO3IKBKB
SCHEMBL29812513 0.78 IKBKB (0.39) AXLMETMERTKIKBKBCHUK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116284043-A Tricyclic compound and medical application thereof 中国科学院上海药物研究所 2023-06-23 CN disclosed
CN-114787144-A Pyridone compounds and methods for modulating protein kinases 埃克塞里艾克西斯公司 2022-07-22 CN disclosed
US-20220073496-A1 NOVEL QUINOLINE DERIVATIVE INHIBITOR TRANSTHERA SCIENCES (NANJING), INC. (CN) 2022-03-10 US disclosed
WO-2020042618-A1 MULTI-SUBSTITUTED PYRIDONE DERIVATIVES AND MEDICAL USE THEREOF 北京越之康泰生物医药科技有限公司 2020-03-05 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 (1 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-20220073496-A1 NOVEL QUINOLINE DERIVATIVE INHIBITOR CSF1R, CSF3R, FLT3 AXL 102/4885MET 246/4885MERTK 17/4885

“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.