SCHEMBL17560822

SCHEMBL17560822

CCCCCCC/C(=N/N=C(N)N)c1ccc(Cl)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.50
LMNA P02545 1/20 0.50
KDM4E B2RXH2 1/20 0.45
ALDH1A1 P00352 1/20 0.45
CCR5 P51681 2/20 0.45
SLC6A4 P31645 1/20 0.43
CYP1A2 P05177 1/20 0.42
BACE1 P56817 1/20 0.38
CDC25A P30304 1/20 0.37
CDC25B P30305 1/20 0.37
DUSP3 P51452 1/20 0.37
HSD17B3 P37058 5/20 0.37
HDAC3 O15379 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC2 Q92769 1/20 0.37
PSEN1 P49768 2/20 0.37
PSEN2 P49810 2/20 0.37
APH1B Q8WW43 2/20 0.37
NCSTN Q92542 2/20 0.37
APH1A Q96BI3 2/20 0.37

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
SCHEMBL17560824 1.00 POLB (0.50) POLBLMNAKDM4EALDH1A1CCR5
SCHEMBL17560819 1.00 POLB (0.50) POLBLMNAKDM4EALDH1A1CCR5
SCHEMBL21283420 0.81 ALDH1A1 (0.49) POLBKDM4EALDH1A1SLC6A4CDC25A
SCHEMBL21283419 0.76 SLC6A4 (0.44) POLBLMNAKDM4EALDH1A1SLC6A4
SCHEMBL19449752 0.75 ALDH1A1 (0.51) POLBLMNAKDM4EALDH1A1SLC6A4
Hydrochloric Acid SCHEMBL17560784 0.74 ALDH1A1 (0.50) POLBLMNAKDM4EALDH1A1SLC6A4
Hydrochloric Acid SCHEMBL17560785 0.74 ALDH1A1 (0.50) POLBLMNAKDM4EALDH1A1SLC6A4
SCHEMBL21882656 0.74 ALDH1A1 (0.52) POLBLMNAKDM4EALDH1A1SLC6A4
SCHEMBL19449764 0.72 ALDH1A1 (0.51) POLBLMNAKDM4EALDH1A1SLC6A4
SCHEMBL21283424 0.72 ALDH1A1 (0.48) POLBLMNAKDM4EALDH1A1SLC6A4

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-10829468-B2 Methods for treating protozoan infections NEOCULI PTY LTD. (AU) 2020-11-10 US claimed
US-20200290990-A1 METHODS FOR TREATING PROTOZOAN INFECTIONS NEOCULI PTY LTD (AU) 2020-09-17 US claimed
US-10392363-B2 Methods for treating protozoan infections NEOCULI PTY LTD. (AU) 2019-08-27 US claimed
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 (4 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-20200290990-A1 METHODS FOR TREATING PROTOZOAN INFECTIONS DPM1, ABCB11, PIGS POLB 3872/4885LMNA 2337/4885KDM4E 3521/4885
US-20170291886-A1 METHODS FOR TREATING PROTOZOAN INFECTIONS DPM1, ABCB11, PIGS POLB 3872/4885LMNA 2337/4885KDM4E 3521/4885
US-10829468-B2 Methods for treating protozoan infections DPM1, ABCB11, PIGS POLB 3872/4885LMNA 2337/4885KDM4E 3521/4885
US-10392363-B2 Methods for treating protozoan infections DPM1, ABCB11, PIGS POLB 3872/4885LMNA 2337/4885KDM4E 3521/4885

“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.