SCHEMBL407762

SCHEMBL407762

CCc1ccc(Br)cc1C1C(=O)[C@@H]2[C@H](C1=O)[C@H]1CC[C@@H]2O1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.36
LMNA P02545 6/20 0.35
SMN1; SMN2 Q16637 5/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
TSHR P16473 2/20 0.35
HPGD P15428 1/20 0.35
TP53 P04637 4/20 0.32
MAPT P10636 2/20 0.32
POLB P06746 1/20 0.32
NOS3 P29474 1/20 0.32
NOS1 P29475 1/20 0.32
NOS2 P35228 1/20 0.32
KDM4E B2RXH2 1/20 0.32
GMNN O75496 1/20 0.32
PPM1B O75688 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

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
SCHEMBL2121466 1.00 MAPK1 (0.36) MAPK1LMNASMN1; SMN2L3MBTL1TSHR
SCHEMBL10266665 0.89 MAPK1 (0.38) MAPK1LMNASMN1; SMN2L3MBTL1TSHR
SCHEMBL2120447 0.89 MAPK1 (0.38) MAPK1LMNASMN1; SMN2L3MBTL1TSHR
SCHEMBL403031 0.85 LMNA (0.38) MAPK1LMNASMN1; SMN2L3MBTL1TSHR
SCHEMBL446693 0.85 LMNA (0.38) MAPK1LMNASMN1; SMN2L3MBTL1TSHR
SCHEMBL447513 0.82 L3MBTL1 (0.40) MAPK1LMNASMN1; SMN2L3MBTL1TSHR
SCHEMBL407231 0.82 LMNA (0.35) MAPK1LMNASMN1; SMN2L3MBTL1TSHR
SCHEMBL405703 0.82 LMNA (0.35) MAPK1LMNASMN1; SMN2L3MBTL1TSHR
SCHEMBL2122975 0.82 ALDH1A1 (0.38) LMNASMN1; SMN2L3MBTL1TSHRHPGD
SCHEMBL448707 0.82 LMNA (0.35) MAPK1LMNASMN1; SMN2L3MBTL1TSHR

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-2389066-B1 CYCLOPENTADIONE DERIVED HERBICIDES SYNGENTA LTD (GB) 2017-07-05 EP disclosed
US-8895474-B2 Herbicidally active cyclopentanediones and derivatives thereof, and their use in controlling weeds SYNGENTA LIMITED (GB) 2014-11-25 US disclosed
US-20120021912-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-01-26 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-20120021912-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 MAPK1 2263/4885LMNA 4657/4885SMN1; SMN2 2952/4885

“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.