SCHEMBL24746194

SCHEMBL24746194

C=Cc1cc(Br)c(F)cc1C(=O)OC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SOS1 Q07889 1/20 0.40
LMNA P02545 2/20 0.37
TSHR P16473 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
NOTUM Q6P988 2/20 0.35
SIRT6 Q8N6T7 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
CA12 O43570 2/20 0.33
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA7 P43166 2/20 0.33
CA9 Q16790 2/20 0.33
CA14 Q9ULX7 2/20 0.33
XDH P47989 2/20 0.33
NR4A2 P43354 1/20 0.33
ERN1 O75460 1/20 0.33
PDK2 Q15119 1/20 0.33
PDK4 Q16654 1/20 0.33
KDM4E B2RXH2 4/20 0.33
SLC6A4 P31645 1/20 0.33

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
SCHEMBL31306166 0.89 CA12 (0.38) SOS1LMNATSHRL3MBTL1CA12
SCHEMBL31394743 0.81 SOS1 (0.51) SOS1LMNATSHRNPSR1NOTUM
SCHEMBL34465654 0.81 KDM4E (0.42) LMNAKDM4EALDH1A1POLBGAA
SCHEMBL22802075 0.81 CA12 (0.42) LMNATSHRL3MBTL1CA12CA1
SCHEMBL21585768 0.81 SOS1 (0.46) SOS1LMNATSHRNPSR1NOTUM
SCHEMBL18360182 0.80 KEAP1 (0.37) CA12CA1CA2CA7CA9
SCHEMBL1044961 0.80 SOS1 (0.46) SOS1LMNATSHRNPSR1NOTUM
SCHEMBL31432736 0.79 SOS1 (0.39) SOS1LMNATSHRNPSR1NOTUM
SCHEMBL10290728 0.78 CYP3A4 (0.38) SOS1LMNATSHRL3MBTL1CA12
SCHEMBL31394733 0.77 SOS1 (0.36) SOS1LMNATSHRNPSR1NOTUM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117120090-A HPK1 antagonists and uses thereof 林伯士萨顿公司 2023-11-24 CN disclosed
WO-2022174253-A1 HPK1 ANTAGONISTS AND USES THEREOF Nimbus Saturn, Inc. (US) 2022-08-18 WO disclosed