SCHEMBL21361227

SCHEMBL21361227

CC(=O)N1CCC2(CC1)CC(=O)C(c1c(C)cc(-c3ccc(Cl)cn3)cc1C)C(=O)C2

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.36
HSD17B10 Q99714 6/20 0.36
HPGD P15428 5/20 0.36
USP2 O75604 3/20 0.36
TSHR P16473 2/20 0.36
HIF1A Q16665 1/20 0.36
CYP2C9 P11712 2/20 0.35
CYP2D6 P10635 4/20 0.35
CYP1A2 P05177 2/20 0.35
MDM4 O15151 1/20 0.34
MDM2 Q00987 1/20 0.34
MAPK1 P28482 2/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
CYP2C19 P33261 1/20 0.34
PTGDR2 Q9Y5Y4 1/20 0.34
MAPK11 Q15759 1/20 0.34
MAPK14 Q16539 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
CNR2 P34972 1/20 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
SCHEMBL21361225 0.88 ABCG2 (0.37) ALDH1A1HSD17B10HPGDUSP2TSHR
SCHEMBL21361314 0.88 SPR (0.37) ALDH1A1HSD17B10HPGDUSP2TSHR
SCHEMBL21361283 0.86 CYP1A2 (0.41) TSHRHIF1ACYP2C9CYP2D6CYP1A2
SCHEMBL22859738 0.86 ALDH1A1 (0.41) ALDH1A1HSD17B10HPGDUSP2TSHR
SCHEMBL21361304 0.85 ALDH1A1 (0.35) ALDH1A1HSD17B10HPGDUSP2TSHR
SCHEMBL29479943 0.84 P2RX7 (0.38) CYP1A2SMN1; SMN2CNR2
SCHEMBL22908414 0.84 CYP1A2 (0.41) TSHRHIF1ACYP2C9CYP2D6CYP1A2
SCHEMBL22941603 0.83 SMO (0.35) HPGDSMN1; SMN2
SCHEMBL22941568 0.81 ABL1 (0.36)
SCHEMBL21357467 0.80 SPR (0.37) ALDH1A1HSD17B10HPGDUSP2TSHR

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
EP-3765445-B1 SPIRO CYCLOHEXANEDIONE DERIVATES AS HERBICIDES SYNGENTA PARTICIPATIONS AG (CH) 2023-08-30 EP disclosed
US-20210000113-A1 SPIRO CYCLOHEXANEDIONE DERIVATES AS HERBICIDES SYNGENTA PARTICIPATIONS AG (CH) 2021-01-07 US disclosed
WO-2019175117-A1 SPIRO CYCLOHEXANEDIONE DERIVATES AS HERBICIDES SYNGENTA PARTICIPATIONS AG (CH) 2019-09-19 WO 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-20210000113-A1 SPIRO CYCLOHEXANEDIONE DERIVATES AS HERBICIDES CBR3, DDT, CBR1 ALDH1A1 26/4885HSD17B10 83/4885HPGD 132/4885

“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.