SCHEMBL17440372

SCHEMBL17440372

CC(=O)Oc1cccc(F)c1Oc1ccc(C(F)(F)F)cn1

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.60
SMN1; SMN2 Q16637 1/20 0.60
HPGD P15428 1/20 0.49
KMT2A Q03164 1/20 0.48
LIPE Q05469 12/20 0.47
POLB P06746 1/20 0.46
LMNA P02545 1/20 0.46
MAPK1 P28482 1/20 0.44

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
SCHEMBL17440383 0.78 TSHR (0.58) TSHRSMN1; SMN2HPGDKMT2ALIPE
SCHEMBL27906089 0.77 LMNA (0.54) TSHRSMN1; SMN2HPGDKMT2ALIPE
SCHEMBL17440373 0.75 KMT2A (0.70) TSHRSMN1; SMN2HPGDKMT2ALIPE
SCHEMBL6631292 0.71 KMT2A (0.64) TSHRSMN1; SMN2HPGDKMT2ALIPE
SCHEMBL20626652 0.69 LIPE (0.67) LIPELMNA
SCHEMBL17355731 0.69 MAPK1 (0.44) TSHRHPGDKMT2APOLBLMNA
SCHEMBL217941 0.68 TSHR (0.50) TSHRSMN1; SMN2HPGDKMT2ALIPE
SCHEMBL11337376 0.68 HPGD (0.69) TSHRSMN1; SMN2HPGDKMT2ALIPE
SCHEMBL11001462 0.68 KMT2A (0.68) TSHRSMN1; SMN2HPGDKMT2ALIPE
SCHEMBL30435803 0.68 KMT2A (0.68) TSHRSMN1; SMN2HPGDKMT2ALIPE

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
US-20170190671-A1 BIS(ARYL)CATECHOL DERIVATIVES AS HERBICIDES FMC CORPORATION 2017-07-06 US disclosed
EP-3169676-A1 BIS(ARYL)CATECHOL DERIVATIVES AS HERBICIDES E. I. du Pont de Nemours and Company (US) 2017-05-24 EP disclosed
WO-2016010731-A1 BIS(ARYL)CATECHOL DERIVATIVES AS HERBICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2016-01-21 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-20170190671-A1 BIS(ARYL)CATECHOL DERIVATIVES AS HERBICIDES DDT, CYP1A1, CYP1B1 TSHR 1334/4885SMN1; SMN2 4717/4885HPGD 1775/4885

“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.