SCHEMBL3107672

SCHEMBL3107672

CC(=O)c1ccc(C(=O)O)c(F)c1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.41
ASPH Q12797 1/20 0.41
KDM8 Q8N371 1/20 0.41
CYP1A2 P05177 1/20 0.41
MYC P01106 3/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA4 P22748 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
HAAO P46952 1/20 0.37
GABRP O00591 1/20 0.37
GABRD O14764 1/20 0.37
GABRA1 P14867 1/20 0.37
GABRB1 P18505 1/20 0.37
GABRG2 P18507 1/20 0.37
GABRB3 P28472 1/20 0.37
GABRA5 P31644 1/20 0.37

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
SCHEMBL3117998 0.82 CYP1A2 (0.48) KDM4ECYP1A2MYCSMN1; SMN2HAAO
SCHEMBL1192063 0.81 CES2 (0.45) KDM4EASPHKDM8CYP1A2MYC
SCHEMBL10662412 0.81 KDM4E (0.42) KDM4EASPHKDM8CYP1A2MYC
SCHEMBL26771499 0.81 CES2 (0.50) KDM4ESMN1; SMN2
SCHEMBL16015491 0.81 HPGD (0.44) KDM4ESMN1; SMN2ALDH1A1HPGD
SCHEMBL6767839 0.79 CSNK2A1 (0.48) KDM4EASPHKDM8CYP1A2MYC
SCHEMBL7573655 0.78 NOTUM (0.46) KDM4EASPHKDM8CYP1A2MYC
SCHEMBL206341 0.78 EPRS1 (0.40) KDM4EASPHKDM8CYP1A2MYC
SCHEMBL5737114 0.78 KDM4E (0.40) KDM4EASPHKDM8CYP1A2MYC
SCHEMBL5517947 0.78 KEAP1 (0.50) KDM4EASPHKDM8CYP1A2MYC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8372867-B2 Insecticidal aryl isoxazoline derivatives BAYER CROPSCIENCE AG (DE) 2013-02-12 US disclosed
US-20100179194-A1 INSECTICIDAL ARYL ISOXAZOLINE DERIVATIVES BAYER CORPSCIENCE AG (DE) 2010-07-15 US disclosed
EP-2181100-A2 INSECTICIDAL ARYL ISOXAZOLINE DERIVATIVES Bayer CropScience AG (DE) 2010-05-05 EP disclosed
WO-2008122375-A2 INSECTICIDAL ARYL ISOXAZOLINE DERIVATIVES BAYER CROPSCIENCE AG (DE) 2008-10-16 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-20100179194-A1 INSECTICIDAL ARYL ISOXAZOLINE DERIVATIVES CYP4X1, AADAC, CYP3A7 KDM4E 1090/4885ASPH 289/4885KDM8 1322/4885

“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.