SCHEMBL13056096

SCHEMBL13056096

O=C(Nc1nsc(C(F)(F)F)n1)c1cc(Cl)ccc1O

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TMPRSS4 Q9NRS4 14/20 0.56
▸ P2RX1 P51575 7/20 0.56
▸ P2RX4 Q99571 5/20 0.56
▸ P2RX7 Q99572 5/20 0.56
▸ MEN1 O00255 1/20 0.56
▸ IKBKB O14920 1/20 0.56
▸ CHUK O15111 1/20 0.56
▸ KDR P35968 1/20 0.56
▸ FLT3 P36888 1/20 0.56
▸ KMT2A Q03164 1/20 0.56
▸ MYLK Q15746 1/20 0.56
▸ MAP4K5 Q9Y4K4 1/20 0.56
▸ SLC2A1 P11166 1/20 0.53
▸ KCNMA1 Q12791 3/20 0.51

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
SCHEMBL13056093 0.82 P2RX1 (0.51) P2RX1P2RX4P2RX7MEN1KMT2A
SCHEMBL14885963 0.78 TAS1R3 (0.60) TMPRSS4P2RX1P2RX4P2RX7MEN1
SCHEMBL30472739 0.77 TMPRSS4 (0.55) TMPRSS4P2RX1P2RX4P2RX7MEN1
SCHEMBL13056139 0.77 TMPRSS4 (0.55) TMPRSS4P2RX1P2RX4P2RX7MEN1
SCHEMBL13055757 0.75 TMPRSS4 (0.51) TMPRSS4P2RX1P2RX4P2RX7MEN1
SCHEMBL14886002 0.74 KCNMA1 (0.57) TMPRSS4P2RX1P2RX4P2RX7MEN1
SCHEMBL14886090 0.73 LMNA (0.72) TMPRSS4P2RX1P2RX4P2RX7KCNMA1
SCHEMBL14885886 0.73 KCNMA1 (0.72) TMPRSS4P2RX1P2RX4P2RX7KDR
SCHEMBL30472757 0.73 P2RX1 (0.62) TMPRSS4P2RX1P2RX4P2RX7MEN1
SCHEMBL18343970 0.72 TMPRSS4 (0.60) TMPRSS4P2RX1P2RX4P2RX7MEN1

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 9 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-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-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
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 TMPRSS4 1983/4885P2RX1 3855/4885P2RX4 3268/4885
US-20140341850-A1 HALOALKYL HETEROARYL BENZAMIDE COMPOUNDS HDHD5, HAVCR2, AADAC TMPRSS4 1983/4885P2RX1 3855/4885P2RX4 3268/4885

“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.

Send feedback