SCHEMBL12239307

SCHEMBL12239307

Cc1cc(C)c(C2C(=O)CC(CC3CCN(C(=O)c4ccc(C(F)(F)F)cc4)CC3)C2=O)c(C)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
HSD11B1 P28845 2/20 0.42
MGLL Q99685 1/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41
MAPK7 Q13164 1/20 0.41
TEAD1 P28347 1/20 0.40
PHGDH O43175 1/20 0.40
SLC9A1 P19634 1/20 0.40
KDM1A O60341 1/20 0.40
CNR1 P21554 1/20 0.39
SYK P43405 1/20 0.38
SIGMAR1 Q99720 1/20 0.38
ALDH1A1 P00352 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38

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
SCHEMBL12239284 0.90 KMT2A (0.50) HSD11B1MGLLMEN1KMT2AHPGD
SCHEMBL12239281 0.90 HSD11B1 (0.46) HSD11B1MEN1KMT2AALDH1A1
SCHEMBL12239286 0.88 MGLL (0.46) HSD11B1MGLLMEN1KMT2AHPGD
SCHEMBL12239278 0.88 HTT (0.45) GAAMEN1KMT2AHPGDALDH1A1
SCHEMBL12239283 0.86 SMN1; SMN2 (0.46) HSD11B1MGLLMEN1KMT2AHPGD
SCHEMBL12239299 0.86 ALDH1A1 (0.54) GAAHSD11B1MGLLMEN1KMT2A
SCHEMBL12239287 0.84 TSHR (0.48) HSD11B1HPGDTSHR
SCHEMBL12239328 0.84 HPGD (0.46) HSD11B1MGLLMEN1KMT2AHPGD
SCHEMBL12239370 0.83 MAPT (0.32) KDM1AALDH1A1EPHX2
SCHEMBL12239333 0.82 KMT2A (0.37) MEN1KMT2AHPGDALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2313370-B1 5-HETEROCYCLYLALKYL-3-HYDROXY-2-PHENYLCYCLOPENT-2-ENONES AS HERBICIDES SYNGENTA LTD (GB) 2015-08-19 EP disclosed
US-9096560-B2 5-heterocyclylalkyl-3-hydroxy-2-phenylcyclopent-2-enones as herbicides SYNGENTA LIMITED (GB) 2015-08-04 US disclosed
US-9096560-B2 5-heterocyclylalkyl-3-hydroxy-2-phenylcyclopent-2-enones as herbicides SYNGENTA LIMITED (GB) 2015-08-04 US disclosed
US-20130053385-A1 METHOD OF COMBATING AND CONTROLLING PESTS SYNGENTA LIMITED (GB) 2013-02-28 US disclosed
US-20130053385-A1 METHOD OF COMBATING AND CONTROLLING PESTS SYNGENTA LIMITED (GB) 2013-02-28 US disclosed
US-20110263428-A1 5-HETEROCYCLYLALKYL-3-HYDROXY-2-PHENYLCYCLOPENT-2-ENONES AS HERBICIDES SYNGENTA CROP PROTECTION, INC. (US) 2011-10-27 US disclosed
US-20110263428-A1 5-HETEROCYCLYLALKYL-3-HYDROXY-2-PHENYLCYCLOPENT-2-ENONES AS HERBICIDES SYNGENTA CROP PROTECTION, INC. (US) 2011-10-27 US disclosed
WO-2011073060-A2 METHOD OF COMBATING AND CONTROLLING PESTS SYNGENTA PARTICIPATIONS AG (CH) 2011-06-23 WO disclosed
WO-2010000773-A1 5-HETEROCYCLYLALKYL-3-HYDROXY-2-PHENYLCYCLOPENT-2-ENONES AS HERBICIDES SYNGENTA LIMITED (GB) 2010-01-07 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-20110263428-A1 5-HETEROCYCLYLALKYL-3-HYDROXY-2-PHENYLCYCLOPENT-2-ENONES AS HERBICIDES DDT, CYP1B1, AHR GAA 889/4885TDP1 2898/4885HSD11B1 1104/4885
US-20130053385-A1 METHOD OF COMBATING AND CONTROLLING PESTS ACHE, ALG1, KEAP1 GAA 170/4885TDP1 3627/4885HSD11B1 2813/4885

“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.