SCHEMBL25061588

SCHEMBL25061588

CCCCOC(=O)C1(CC)CC(C)=NO1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
POLB P06746 1/20 0.36
ALDH1A1 P00352 2/20 0.36
ATM Q13315 1/20 0.34
ESR1 P03372 4/20 0.33
PSEN1 P49768 3/20 0.33
TSHR P16473 3/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
MAPT P10636 2/20 0.33
MAPK1 P28482 2/20 0.33
ABCB11 O95342 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
HPGD P15428 1/20 0.33
MIF P14174 3/20 0.32
PRKCA P17252 1/20 0.32
F2 P00734 1/20 0.32
KMT2A Q03164 1/20 0.32
HSD17B10 Q99714 1/20 0.32
CYP1A2 P05177 1/20 0.32

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
SCHEMBL25061664 0.82 GABRP (0.32) KMT2A
SCHEMBL25061481 0.82 SMN1; SMN2 (0.34) LMNASMN1; SMN2POLBALDH1A1ATM
SCHEMBL25061655 0.79 TSHR (0.32) TSHR
SCHEMBL25061447 0.79 ABCB11 (0.43) LMNAPOLBALDH1A1ATMPSEN1
SCHEMBL25061662 0.78
SCHEMBL24471503 0.76 ATM (0.36) LMNASMN1; SMN2POLBATMTSHR
SCHEMBL25061581 0.75 ABCB11 (0.32) LMNAMAPTMAPK1ABCB11
SCHEMBL14967664 0.75 ALDH1A1 (0.50) LMNASMN1; SMN2POLBALDH1A1ATM
SCHEMBL25061767 0.74 F10 (0.38) LMNAPOLBALDH1A1ATMTSHR
SCHEMBL25061614 0.73 CRBN (0.33)

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-20230053699-A1 SUBSTITUTED-ISOXAZOLINE-CONTAINING AROMATIC COMPOUND, PREPARATION METHOD THEREFOR, HERBICIDAL COMPOSITION AND USE THEREOF QINGDAO KINGAGROOT CHEMICAL COMPOUND CO., LTD. (CN) 2023-02-23 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-20230053699-A1 SUBSTITUTED-ISOXAZOLINE-CONTAINING AROMATIC COMPOUND, PREPARATION METHOD THEREFOR, HERBICIDAL COMPOSITION AND USE THEREOF CYP4X1, CYP4F11, CBR3 LMNA 3832/4885SMN1; SMN2 4858/4885POLB 3229/4885

“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.