SCHEMBL25101421

SCHEMBL25101421

COC(=O)c1noc(C2CC2)c1C(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.36
LMNA P02545 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
POLB P06746 1/20 0.34
GAA P10253 1/20 0.34
TSHR P16473 1/20 0.34
NR1H4 Q96RI1 5/20 0.33
HCRTR2 O43614 2/20 0.33
HCRTR1 O43613 1/20 0.33
STAT1 P42224 1/20 0.32
RAF1 P04049 1/20 0.31
KMT2A Q03164 1/20 0.31
SMURF1 Q9HCE7 1/20 0.31
CNR2 P34972 4/20 0.30
TP53 P04637 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL25101414 0.84 MLYCD (0.37) TSHRKMT2AMAPT
SCHEMBL1811981 0.80 SMURF1 (0.37) NPSR1SMN1; SMN2TSHRSMURF1CNR2
SCHEMBL15962404 0.80 SMURF1 (0.42) NPSR1LMNASMN1; SMN2POLBGAA
SCHEMBL19498010 0.70
SCHEMBL22604119 0.68
SCHEMBL2567888 0.68 PTGS1 (0.56) LMNASMN1; SMN2GAATP53MAPT
SCHEMBL10285808 0.68 NPSR1 (0.38) NPSR1SMN1; SMN2GAATSHRHCRTR2
SCHEMBL25101409 0.67
SCHEMBL17843215 0.67 NPSR1 (0.39) NPSR1LMNASMN1; SMN2POLB
SCHEMBL25101251 0.66

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230075221-A1 SUBSTITUTED 1,2,4-TRIAZOLO[4,3-A]PYRIDINE DERIVATIVE AND PREPARATION METHOD, HERBICIDAL COMPOSITION AND APPLICATION THEREOF QINGDAO KINGAGROOT CHEMICAL COMPOUND CO., LTD. (CN) 2023-03-09 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-20230075221-A1 SUBSTITUTED 1,2,4-TRIAZOLO[4,3-A]PYRIDINE DERIVATIVE AND PREPARATION METHOD, HERBICIDAL COMPOSITION AND APPLICATION THEREOF TH, CYP4X1, CYP4B1 NPSR1 1524/4885LMNA 3067/4885SMN1; SMN2 4553/4885

“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.