SCHEMBL14601747

SCHEMBL14601747

N=C(Nc1ccc(C(F)(F)F)c(C(F)(F)F)c1)Nc1ccc(C(F)(F)F)c(C(F)(F)F)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TMPRSS4 Q9NRS4 1/20 0.49
KDR P35968 1/20 0.49
PDK1 Q15118 1/20 0.47
LMNA P02545 4/20 0.42
AR P10275 3/20 0.42
HTT P42858 3/20 0.42
CYP3A4 P08684 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
CES2 O00748 1/20 0.42
ABCB11 O95342 1/20 0.42
ALDH1A1 P00352 1/20 0.42
CYP1A2 P05177 1/20 0.42
GLA P06280 1/20 0.42
ADORA3 P0DMS8 1/20 0.42
CHRM1 P11229 1/20 0.42
CYP2C9 P11712 1/20 0.42
ALOX15 P16050 1/20 0.42
TSHR P16473 1/20 0.42
TBXA2R P21731 1/20 0.42
AADAC P22760 1/20 0.42

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
Hydrochloric Acid SCHEMBL5597980 0.98 TMPRSS4 (0.48) TMPRSS4KDRPDK1LMNAAR
SCHEMBL14601746 0.85 MAPT (0.59) TMPRSS4KDRPDK1LMNAHTT
SCHEMBL14459549 0.85 KDR (0.70) TMPRSS4KDRPDK1LMNAHTT
Hydrochloric Acid SCHEMBL5597742 0.83 MAPT (0.57) TMPRSS4KDRPDK1LMNAHTT
Hydrochloric Acid SCHEMBL5597854 0.83 KDR (0.68) TMPRSS4KDRPDK1LMNAHTT
SCHEMBL8902443 0.79 CYP1A2 (0.54) TMPRSS4KDRPDK1LMNAAR
SCHEMBL11307468 0.78 AR (0.56) TMPRSS4KDRPDK1LMNAAR
SCHEMBL11879435 0.78 ALDH1A1 (0.68) TMPRSS4KDRPDK1LMNAAR
SCHEMBL22092639 0.78 KDR (0.60) KDRPDK1LMNAHTTCYP3A4
SCHEMBL12057514 0.76 KDR (0.62) TMPRSS4KDRPDK1LMNAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070021509-A1 Phosphate transport inhibitors JOZEFIAK THOMAS H 2007-01-25 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-20070021509-A1 Phosphate transport inhibitors SLC34A2, SLC34A1, SLC20A1 TMPRSS4 2616/4885KDR 3782/4885PDK1 1488/4885

“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.