SCHEMBL17560977

SCHEMBL17560977

O=C(NN=Cc1ccccc1Cl)NN=Cc1ccccc1Cl

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DUSP3 P51452 1/20 0.66
PTPN5 P54829 1/20 0.66
PTPN11 Q06124 1/20 0.66
LMNA P02545 3/20 0.65
NPC1 O15118 3/20 0.65
RAB9A P51151 3/20 0.65
MAPT P10636 3/20 0.65
ALDH1A1 P00352 3/20 0.63
FAAH O00519 1/20 0.62
MGLL Q99685 1/20 0.62
KMT2A Q03164 2/20 0.61
SMN1; SMN2 Q16637 2/20 0.58
HPGD P15428 1/20 0.58
HTT P42858 1/20 0.58
MEN1 O00255 1/20 0.58
NPSR1 Q6W5P4 1/20 0.58
CA1 P00915 1/20 0.58
CA9 Q16790 1/20 0.58
CYP1A2 P05177 1/20 0.56
CYP2C19 P33261 1/20 0.56

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
SCHEMBL20834535 1.00 DUSP3 (0.66) DUSP3PTPN5PTPN11LMNANPC1
SCHEMBL19449700 0.91 FAAH (0.57) DUSP3PTPN5PTPN11LMNANPC1
SCHEMBL28642848 0.86 NPC1 (0.61) LMNANPC1RAB9AMAPTALDH1A1
SCHEMBL17560748 0.86 NPC1 (0.61) LMNANPC1RAB9AMAPTALDH1A1
SCHEMBL17560750 0.86 NPC1 (0.61) LMNANPC1RAB9AMAPTALDH1A1
Hydrochloric Acid SCHEMBL21519598 0.84 NPC1 (0.60) LMNANPC1RAB9AMAPTALDH1A1
SCHEMBL11386820 0.83 LMNA (0.71) LMNANPC1RAB9AMAPTALDH1A1
SCHEMBL13475713 0.83 NPC1 (0.81) LMNANPC1RAB9AMAPTALDH1A1
SCHEMBL11386823 0.83 LMNA (0.71) LMNANPC1RAB9AMAPTALDH1A1
SCHEMBL19449730 0.81 NPC1 (0.58) LMNANPC1RAB9AMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170291886-A1 METHODS FOR TREATING PROTOZOAN INFECTIONS NEOCULI PTY LTD (AU) 2017-10-12 US claimed
EP-3188722-A1 METHODS FOR TREATING PROTOZOAN INFECTIONS Neoculi Pty Ltd (AU) 2017-07-12 EP claimed
WO-2016033635-A1 METHODS FOR TREATING PROTOZOAN INFECTIONS NEOCULI PTY LTD (AU) 2016-03-10 WO claimed

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-20170291886-A1 METHODS FOR TREATING PROTOZOAN INFECTIONS DPM1, ABCB11, PIGS DUSP3 3658/4885PTPN5 3803/4885PTPN11 4366/4885

“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.