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SCHEMBL10187541

SCHEMBL10187541

Cc1cc(Br)cc(C)c1C1=C(O)[C@H]2[C@@H](C1=O)[C@@H]1CC[C@H]2O1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ GMNN O75496 1/20 0.32
▸ PPM1B O75688 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ PPP1CC P36873 1/20 0.32
▸ TFPI2 P48307 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ PPP5C P53041 1/20 0.32
▸ PPP1CA P62136 1/20 0.32
▸ PMP22 Q01453 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ CYP2D6 P10635 1/20 0.32
▸ NFKB1 P19838 1/20 0.32
▸ THPO P40225 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
SCHEMBL13261980 1.00 L3MBTL1 (0.34) L3MBTL1SMN1; SMN2KDM4EGMNNPPM1B
SCHEMBL10257452 0.89 L3MBTL1 (0.35) L3MBTL1SMN1; SMN2KDM4EGMNNPPM1B
SCHEMBL10257983 0.86 L3MBTL1 (0.33) L3MBTL1SMN1; SMN2KDM4EGMNNPPM1B
SCHEMBL10187606 0.84 L3MBTL1 (0.31) L3MBTL1
SCHEMBL10187609 0.84 KDM4E (0.33) KDM4E
SCHEMBL10257698 0.84 KDM4E (0.33) L3MBTL1SMN1; SMN2KDM4ELMNAPPP1CA
SCHEMBL10258277 0.83 L3MBTL1 (0.44) L3MBTL1SMN1; SMN2KDM4EGMNNPPM1B
SCHEMBL15001121 0.83 CNR1 (0.32) L3MBTL1
SCHEMBL16196724 0.82 L3MBTL1 (0.33) L3MBTL1SMN1; SMN2KDM4EGMNNPPM1B
SCHEMBL15001710 0.82 L3MBTL1 (0.33) L3MBTL1SMN1; SMN2KDM4EGMNNPPM1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2393769-B1 NOVEL HERBICIDES SYNGENTA LTD (GB) 2014-12-10 — — EP disclosed
EP-2185564-B1 Herbicidally active cyclopentanedione compounds and derivatives thereof SYNGENTA LTD (GB) 2014-06-18 — — EP disclosed
US-8754242-B2 Herbicides SYNGENTA CROP PROTECTION LLC (US) 2014-06-17 — — US disclosed
US-8754242-B2 Herbicides SYNGENTA CROP PROTECTION LLC (US) 2014-06-17 — — US disclosed
US-8680339-B2 Herbicides SYNGENTA LIMITED (GB) 2014-03-25 — — US disclosed
US-8680339-B2 Herbicides SYNGENTA LIMITED (GB) 2014-03-25 — — US disclosed
US-20120094832-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2012-04-19 — — US disclosed
US-20120094832-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2012-04-19 — — US disclosed
US-20120028800-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-02-02 — — US disclosed
US-20120028800-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-02-02 — — US disclosed
WO-2009019005-A2 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2009-02-12 — — 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 (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-20120094832-A1 NOVEL HERBICIDES DDT, CYP1B1, CYP1A1 L3MBTL1 1525/4885SMN1; SMN2 2924/4885KDM4E 1070/4885
US-20120028800-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 L3MBTL1 1453/4885SMN1; SMN2 2952/4885KDM4E 1092/4885

“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.