SCHEMBL13056066

SCHEMBL13056066

COC(=O)c1cccc(C(=O)Nc2nc(C(F)(F)C(F)(F)F)ns2)c1O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.42
▸ ALDH1A1 P00352 3/20 0.39
▸ TP53 P04637 2/20 0.39
▸ MEN1 O00255 3/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ PDK1 Q15118 1/20 0.38
▸ PDK2 Q15119 1/20 0.38
▸ PDK3 Q15120 1/20 0.38
▸ PDK4 Q16654 1/20 0.38
▸ KDM4E B2RXH2 2/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ THRB P10828 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ DDX3X O00571 1/20 0.36
▸ AR P10275 1/20 0.36

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
SCHEMBL16253956 0.86 P2RX1 (0.49) MAPTALDH1A1TP53MEN1KMT2A
SCHEMBL13055734 0.84 NPC1 (0.52) MAPTALDH1A1TP53MEN1KMT2A
SCHEMBL13081444 0.81 ALDH1A1 (0.49) MAPTALDH1A1TP53MEN1KMT2A
SCHEMBL13056127 0.78 P2RX1 (0.37) MAPTALDH1A1TP53MEN1KMT2A
SCHEMBL16253957 0.75 STAT3 (0.47) MAPTALDH1A1TP53MEN1KMT2A
SCHEMBL13055873 0.75 IRAK4 (0.36) MAPTALDH1A1MEN1KMT2ARAB9A
SCHEMBL13056171 0.72 EGLN1 (0.36) MAPTALDH1A1TP53MEN1KMT2A
SCHEMBL13081427 0.71 KDM4E (0.49) ALDH1A1TP53MEN1KMT2ARAB9A
SCHEMBL13056058 0.71 NPC1 (0.57) MAPTALDH1A1TP53MEN1KMT2A
SCHEMBL16130567 0.70 NPC1 (0.56) MAPTALDH1A1TP53MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE47786-E1 Haloalkyl heteroaryl benzamide compounds ROMARK LABORATORIES L.C. (US) 2019-12-31 — — US disclosed
US-RE46724-E1 Haloalkyl heteroaryl benzamide compounds ROMARK LABORATORIES, L.C. (US) 2018-02-20 — — US disclosed
US-20140341850-A1 HALOALKYL HETEROARYL BENZAMIDE COMPOUNDS ROMARK LABORATORIES, L.C. (US) 2014-11-20 — — US disclosed
US-8846727-B2 Haloalkyl heteroaryl benzamide compounds ROMARK LABORATORIES, L.C. (US) 2014-09-30 — — US disclosed
US-8846727-B2 Haloalkyl heteroaryl benzamide compounds ROMARK LABORATORIES, L.C. (US) 2014-09-30 — — US disclosed
US-20100292274-A1 HALOALKYL HETEROARYL BENZAMIDE COMPOUNDS ROMARK LABORATORIES L.C. 2010-11-18 — — 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 (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-20100292274-A1 HALOALKYL HETEROARYL BENZAMIDE COMPOUNDS HDHD5, HAVCR2, AADAC MAPT 4286/4885ALDH1A1 1393/4885TP53 2815/4885
US-20140341850-A1 HALOALKYL HETEROARYL BENZAMIDE COMPOUNDS HDHD5, HAVCR2, AADAC MAPT 4286/4885ALDH1A1 1393/4885TP53 2815/4885

“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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