SCHEMBL30396325

SCHEMBL30396325

CC(C)(C)OC(=O)Nc1cccc(CO)n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 1/20 0.42
SCN9A Q15858 3/20 0.42
LCK P06239 2/20 0.41
GRM5 P41594 1/20 0.40
NR3C2 P08235 1/20 0.40
CHRNB2 P17787 1/20 0.40
CHRNB4 P30926 1/20 0.40
CHRNA3 P32297 1/20 0.40
CHRNA4 P43681 1/20 0.40
CYP17A1 P05093 1/20 0.39
GLS O94925 1/20 0.39
RAB9A P51151 2/20 0.39
MEN1 O00255 1/20 0.39
NPC1 O15118 1/20 0.39
GAA P10253 1/20 0.39
KMT2A Q03164 1/20 0.39
CDK5 Q00535 1/20 0.39
CDK5R1 Q15078 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MAPK8 P45983 1/20 0.38

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
SCHEMBL465792 1.00 CCR2 (0.42) CCR2SCN9ALCKGRM5NR3C2
SCHEMBL6320838 0.89 NR3C2 (0.43) CCR2SCN9ALCKNR3C2CHRNB2
SCHEMBL4076010 0.88 CHRNB2 (0.51) CCR2SCN9ALCKNR3C2CHRNB2
SCHEMBL29988292 0.87 GLS (0.42) CCR2SCN9ALCKNR3C2CHRNB2
SCHEMBL2827164 0.87 GLS (0.42) CCR2SCN9ALCKNR3C2CHRNB2
SCHEMBL8307596 0.87 CCR2 (0.44) CCR2SCN9ALCKNR3C2CHRNB2
SCHEMBL6681771 0.87 CCR2 (0.42) CCR2SCN9ALCKNR3C2CHRNB2
SCHEMBL1022260 0.87 GLS (0.42) CCR2SCN9ALCKNR3C2CHRNB2
SCHEMBL21198393 0.87 CCR2 (0.42) CCR2SCN9ALCKNR3C2CHRNB2
SCHEMBL29394473 0.86 LCK (0.47) LCKRAB9AMEN1NPC1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024083086-A1 BICYCLIC DERIVATIVE INTEGRIN INHIBITOR 上海如凌生物医药有限公司 2024-04-25 WO disclosed
WO-2023143135-A1 QUINAZOLINE DERIVATIVE AND USE THEREOF 赛诺哈勃药业(成都)有限公司 2023-08-03 WO disclosed
US-11641858-B2 Agricultural chemicals REDAG CROP PROTECTION LTD. (GB) 2023-05-09 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-11641858-B2 Agricultural chemicals DDT, CYP4X1, CYP1A2 CCR2 2687/4885SCN9A 3816/4885LCK 2704/4885

“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.