SCHEMBL16675445

SCHEMBL16675445

ON(O)c1cc(Cl)ccc1Cl

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.48
ALDH1A1 P00352 4/20 0.48
HSD17B10 Q99714 3/20 0.48
CYP3A4 P08684 2/20 0.48
TDP1 Q9NUW8 1/20 0.48
TP53 P04637 3/20 0.48
FSCN1 Q16658 1/20 0.39
SIGMAR1 Q99720 4/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
CASP1 P29466 1/20 0.37
MEN1 O00255 1/20 0.36
POLB P06746 1/20 0.36
KMT2A Q03164 1/20 0.36
HTT P42858 1/20 0.35
HPGD P15428 1/20 0.34
ALOX15 P16050 1/20 0.34
ALOX12 P18054 1/20 0.34
MAPK1 P28482 1/20 0.34

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
SCHEMBL16900683 0.76 IDO1 (0.33) TSHRALDH1A1HSD17B10CYP3A4TDP1
SCHEMBL30627908 0.76 ALDH1A1 (0.40) TSHRALDH1A1HSD17B10CYP3A4TDP1
SCHEMBL3736685 0.76 ALDH1A1 (0.40) TSHRALDH1A1HSD17B10CYP3A4TDP1
SCHEMBL1039636 0.75 GAA (0.54) TSHRALDH1A1HSD17B10CYP3A4TDP1
SCHEMBL11052434 0.74 HTT (0.39) TSHRALDH1A1HSD17B10CYP3A4TDP1
SCHEMBL14702114 0.73 TSHR (0.46) TSHRALDH1A1HSD17B10CYP3A4TDP1
SCHEMBL16914828 0.73 HTT (0.47) TSHRALDH1A1HSD17B10CYP3A4TDP1
SCHEMBL11811760 0.71 ALDH1A1 (0.42) TSHRALDH1A1CYP3A4TDP1TP53
SCHEMBL11741152 0.70 FSCN1 (0.53) TSHRALDH1A1HSD17B10CYP3A4TDP1
SCHEMBL5797586 0.70 SIGMAR1 (0.44) TSHRALDH1A1HSD17B10CYP3A4TDP1

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-20150119571-A1 NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2015-04-30 US disclosed
US-20150119571-A1 NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2015-04-30 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-20150119571-A1 NEPRILYSIN INHIBITORS MME, REN, ACE TSHR 1047/4885ALDH1A1 2394/4885HSD17B10 4111/4885

“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.