SCHEMBL22992179

SCHEMBL22992179

CC#Cc1cc(C)c(C2C(=O)CC3(CCN(C(=O)NC(=O)c4ccncc4)CC3)CC2=O)c(C)c1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 15/20 0.39
TSHR P16473 3/20 0.36
CYP1A2 P05177 2/20 0.36
HSD17B10 Q99714 3/20 0.34
CYP2D6 P10635 6/20 0.33
CYP2C9 P11712 2/20 0.33
USP2 O75604 1/20 0.33
ALDH1A1 P00352 2/20 0.33
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
POLB P06746 1/20 0.33
CYP2C19 P33261 2/20 0.33
SMN1; SMN2 Q16637 2/20 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
SCHEMBL22992075 0.91 GAA (0.41) CYP3A4TSHRCYP1A2HSD17B10CYP2C9
SCHEMBL21344277 0.90 ALDH1A1 (0.36) ALDH1A1KMT2AMEN1POLBSMN1; SMN2
SCHEMBL22992155 0.89 CYP3A4 (0.44) CYP3A4TSHRCYP1A2HSD17B10CYP2D6
SCHEMBL21343728 0.86 CYP3A4 (0.31) CYP3A4KMT2AMEN1
SCHEMBL22942059 0.85 RAB9A (0.35) CYP3A4TSHRHSD17B10CYP2D6ALDH1A1
SCHEMBL21344248 0.85 HIF1A (0.32)
SCHEMBL21343726 0.84 NAMPT (0.33)
SCHEMBL21344680 0.83 NAMPT (0.35)
SCHEMBL21344260 0.83
SCHEMBL22992095 0.83 PIK3CA (0.34) HSD17B10CYP2D6POLB

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
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 CYP3A4 245/4885TSHR 1353/4885CYP1A2 14/4885
US-12043599-B2 Herbicidal compounds DDT, CBR3, GLRX3 CYP3A4 245/4885TSHR 1353/4885CYP1A2 14/4885

“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.