SCHEMBL10196249

SCHEMBL10196249

CCc1ccc(Oc2ccc(C(F)(F)F)cc2Br)cc1C1=C(O)C2C(C1=O)[C@H]1CC[C@@H]2CC1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.35
ESRRA P11474 1/20 0.35
ATM Q13315 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
SLC6A4 P31645 7/20 0.34
FFAR1 O14842 1/20 0.34
CYP1A2 P05177 2/20 0.33
CYP2C9 P11712 2/20 0.33
CYP2C19 P33261 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
THRB P10828 2/20 0.33
CYP2D6 P10635 1/20 0.33
CYP26A1 O43174 1/20 0.33
HTR2A P28223 5/20 0.32
KCNH2 Q12809 5/20 0.32
RAB9A P51151 1/20 0.32
THRA P10827 1/20 0.32
PPARD Q03181 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
SCHEMBL19071584 1.00 CYP3A4 (0.35) CYP3A4ESRRAATML3MBTL1LMNA
SCHEMBL16257129 0.91 FFAR1 (0.38) ATML3MBTL1LMNAMAPTSLC6A4
SCHEMBL10196247 0.89 FFAR1 (0.43) ESRRAATML3MBTL1LMNAMAPT
SCHEMBL19070944 0.89 FFAR1 (0.43) ESRRAATML3MBTL1LMNAMAPT
SCHEMBL19070814 0.88 L3MBTL1 (0.34) ATML3MBTL1LMNAMAPTSLC6A4
SCHEMBL19071205 0.87 KDM4E (0.35) ESRRAATML3MBTL1LMNAMAPT
SCHEMBL10196292 0.86 MAPT (0.43) ESRRAL3MBTL1LMNAMAPTCYP2C9
SCHEMBL16257120 0.83 AR (0.37) SLC6A4HTR2AKCNH2
SCHEMBL19070669 0.82 MAPK14 (0.32) KCNH2
SCHEMBL10196143 0.82 MAPK14 (0.32) KCNH2

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 5 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-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
WO-2010102848-A1 CYCLOPENTADIONE DERIVED HERBICIDES SYNGENTA LIMITED (GB) 2010-09-16 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-20120021912-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 CYP3A4 424/4885ESRRA 891/4885ATM 3729/4885

“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.