SCHEMBL15935175

SCHEMBL15935175

Cc1nn(-c2ccnc(C(F)(F)F)c2)cc1F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 6/20 0.46
GRIN1 Q05586 6/20 0.46
GRIN2B Q13224 6/20 0.46
AR P10275 1/20 0.44
LOXL2 Q9Y4K0 2/20 0.37
LOX P28300 1/20 0.36
CYP17A1 P05093 3/20 0.36
GRM4 Q14833 1/20 0.35
PSEN1 P49768 1/20 0.34
PSEN2 P49810 1/20 0.34
APH1B Q8WW43 1/20 0.34
NCSTN Q92542 1/20 0.34
APH1A Q96BI3 1/20 0.34
PSENEN Q9NZ42 1/20 0.34
GRM2 Q14416 1/20 0.34
PTGS2 P35354 2/20 0.33
MALT1 Q9UDY8 1/20 0.33
ELANE P08246 1/20 0.33
SMARCA2 P51531 1/20 0.33
SMARCA4 P51532 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
SCHEMBL15924205 0.82 RXRA (0.41) RXRAGRIN1GRIN2BARLOXL2
SCHEMBL27137556 0.81 RXRA (0.42) RXRAGRIN1GRIN2BARCYP17A1
SCHEMBL15935171 0.77 ELOVL1 (0.42) RXRAGRIN1GRIN2BLOXL2LOX
SCHEMBL15935047 0.77 CYP11B1 (0.36) RXRAGRIN1GRIN2B
SCHEMBL15832232 0.76 AR (0.46) RXRAGRIN1GRIN2BARLOXL2
SCHEMBL15935168 0.75 GRM4 (0.35) GRM4
SCHEMBL27136757 0.75 RXRA (0.53) RXRAGRIN1GRIN2BARLOXL2
SCHEMBL15935043 0.74 GRM4 (0.39) GRM4PTGS2
SCHEMBL15935020 0.71 CYP17A1 (0.36) CYP17A1MALT1
SCHEMBL15825104 0.70 AR (0.43) RXRAGRIN1GRIN2BARLOXL2

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
EP-2934538-B1 FACTOR IXA INHIBITORS MERCK SHARP & DOHME (US) 2021-03-31 EP disclosed
US-9708308-B2 Factor IXa inhibitors MERCK SHARP DOHME CORP. (US) 2017-07-18 US disclosed
US-20150322056-A1 Factor IXa Inhibitors MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2015-11-12 US disclosed
WO-2014120346-A1 FACTOR IXA INHIBITORS MERCK SHARP & DOHME CORP. (US) 2014-08-07 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 (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-20150322056-A1 Factor IXa Inhibitors F9, F12, F8 RXRA 1838/4885GRIN1 3949/4885GRIN2B 3708/4885

“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.