SCHEMBL29317841

SCHEMBL29317841

COC(=O)c1cc(Oc2ccnc3ccccc23)cc(C(=O)OC)c1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.49
KDR P35968 7/20 0.47
BRAF P15056 1/20 0.47
MAPK14 Q16539 1/20 0.47
TNNI3K Q59H18 1/20 0.47
DDR2 Q16832 1/20 0.47
PDGFRA P16234 5/20 0.46
AXL P30530 2/20 0.46
MET P08581 2/20 0.46
KIT P10721 2/20 0.44
MAPK1 P28482 1/20 0.44
ALOX15 P16050 1/20 0.44
HTT P42858 1/20 0.44
SRC P12931 1/20 0.43
TGFBR1 P36897 1/20 0.43
FGFR2 P21802 1/20 0.43
AURKA O14965 1/20 0.42
TEK Q02763 1/20 0.42
AURKB Q96GD4 1/20 0.42

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
SCHEMBL22972009 0.94 DDR2 (0.56) USP2KDRBRAFMAPK14TNNI3K
SCHEMBL22972145 0.82 DDR2 (0.54) KDRBRAFMAPK14TNNI3KDDR2
SCHEMBL30050285 0.82 DDR2 (0.54) KDRBRAFMAPK14TNNI3KDDR2
SCHEMBL30049303 0.82 DDR2 (0.54) KDRDDR2PDGFRAAXLMET
SCHEMBL29318681 0.82 DDR2 (0.54) KDRDDR2PDGFRAAXLMET
SCHEMBL22972012 0.81 SMN1; SMN2 (0.49) KDRBRAFMAPK14TNNI3KAXL
SCHEMBL24724269 0.79 MEN1 (0.58) KDRBRAFMAPK14TNNI3KPDGFRA
SCHEMBL29317823 0.79 DDR2 (0.54) BRAFDDR2PDGFRAHTTFGFR2
SCHEMBL24724242 0.79 KDR (0.50) KDRBRAFMAPK14TNNI3KPDGFRA
SCHEMBL22972144 0.77 AKR1C3 (0.56) KDRBRAFMAPK14TNNI3K

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
US-20240239806-A1 COMPOUNDS, COMPOSITIONS AND METHODS OF TREATING DISORDERS CHENGDU ANTICANCER BIOSCIENCE LTD (CN) 2024-07-18 US disclosed
US-20240239806-A1 COMPOUNDS, COMPOSITIONS AND METHODS OF TREATING DISORDERS CHENGDU ANTICANCER BIOSCIENCE LTD (CN) 2024-07-18 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 (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-20240239806-A1 COMPOUNDS, COMPOSITIONS AND METHODS OF TREATING DISORDERS CYP27A1, CPT1A, OAT USP2 3182/4885KDR 4885/4885BRAF 3355/4885

“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.