SCHEMBL13611319

SCHEMBL13611319

C=C(CC)COc1ccnc(C(F)(F)F)c1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ LOXL2 Q9Y4K0 2/20 0.41
▸ LOX P28300 1/20 0.40
▸ PPARD Q03181 1/20 0.38
▸ RXRA P19793 2/20 0.36
▸ GRIN1 Q05586 2/20 0.36
▸ GRIN2B Q13224 2/20 0.36
▸ IDO1 P14902 1/20 0.35
▸ LRRK2 Q5S007 1/20 0.34
▸ TGFBR1 P36897 1/20 0.34
▸ MGLL Q99685 1/20 0.34
▸ SMARCA2 P51531 1/20 0.33
▸ SMARCA4 P51532 1/20 0.33
▸ VNN1 O95497 1/20 0.33
▸ AR P10275 1/20 0.33
▸ NOTUM Q6P988 1/20 0.33

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
SCHEMBL19155133 0.82 LOXL2 (0.38) LOXL2LOXPPARDRXRAGRIN1
SCHEMBL1662471 0.79 LOXL2 (0.49) LOXL2LOXRXRAGRIN1GRIN2B
SCHEMBL25213572 0.77 PTPN7 (0.46) LOXL2LOXPPARDSMARCA2SMARCA4
SCHEMBL25248872 0.74 PSEN1 (0.50) LOXL2LOXMGLLSMARCA2SMARCA4
SCHEMBL13603746 0.73 PPARD (0.54) PPARD
SCHEMBL10200740 0.73 LOXL2 (0.46) LOXL2LOXRXRAGRIN1GRIN2B
SCHEMBL1662456 0.72 CCR1 (0.55) LOXL2LOXIDO1LRRK2NOTUM
SCHEMBL27894825 0.71 LOXL2 (0.50) LOXL2LOXIDO1LRRK2TGFBR1
SCHEMBL13603977 0.70 MAOB (0.50) PPARD
SCHEMBL28406146 0.70 LOXL2 (0.42) LOXL2LOXRXRAGRIN1GRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7638514-B2 Agriculture SYNGENTA CROP PROTECTION, INC. (US) 2009-12-29 — — US disclosed
US-20070142229-A1 Pesticidally active phenol derivatives SYNGENTA CROP PROTECTION, INC. 2007-06-21 — — 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-20070142229-A1 Pesticidally active phenol derivatives DDT, QSOX1, CHRM1 LOXL2 1227/4885LOX 902/4885PPARD 3297/4885

“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.

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