SCHEMBL22992227

SCHEMBL22992227

CC#Cc1cc(C)c(C2C(=O)CC3(CCN(C(=O)OC)CC3)CC2=O)c(C)c1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 2/20 0.42
CYP3A4 P08684 7/20 0.39
CYP2C19 P33261 6/20 0.39
MAPK1 P28482 3/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
CYP2D6 P10635 7/20 0.39
HSD17B10 Q99714 5/20 0.39
ALDH1A1 P00352 2/20 0.38
USP2 O75604 3/20 0.38
TSHR P16473 3/20 0.37
HIF1A Q16665 2/20 0.37
CYP2C9 P11712 3/20 0.37
CYP1A2 P05177 3/20 0.36
HPGD P15428 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
SCHEMBL24325229 0.89 GRM5 (0.33) GRM5
SCHEMBL22992125 0.89 CYP2D6 (0.33) GRM5CYP3A4CYP2C19MAPK1CYP2D6
SCHEMBL21273942 0.89 GPR183 (0.41)
SCHEMBL21274392 0.88 USP2 (0.35) CYP3A4CYP2C19MAPK1MEN1KMT2A
SCHEMBL22992145 0.88 GAA (0.33)
SCHEMBL21274089 0.88 BTK (0.30)
SCHEMBL24325242 0.88 GRM5 (0.32) GRM5
SCHEMBL22992095 0.87 PIK3CA (0.34) GRM5CYP2D6HSD17B10HIF1A
SCHEMBL21343738 0.87 MAPK1 (0.32) GRM5MAPK1
SCHEMBL21343731 0.86 GRM5 (0.31) GRM5

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
US-12043599-B2 Herbicidal compounds SYNGENTA PARTICIPATIONS AG (CH) 2024-07-23 US disclosed
US-12043599-B2 Herbicidal compounds SYNGENTA PARTICIPATIONS AG (CH) 2024-07-23 US disclosed
EP-3762378-B1 HERBICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2022-05-18 EP disclosed
US-20210047274-A1 HERBICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2021-02-18 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 (2 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-20210047274-A1 HERBICIDAL COMPOUNDS DDT, CBR3, GLRX3 GRM5 1037/4885CYP3A4 245/4885CYP2C19 286/4885
US-12043599-B2 Herbicidal compounds DDT, CBR3, GLRX3 GRM5 1037/4885CYP3A4 245/4885CYP2C19 286/4885

“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.