SCHEMBL4335877

SCHEMBL4335877

CN(C)CC/C(=N\N(Cc1cccnc1)C(N)=S)c1ccc(-c2cccc(Cl)c2)o1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.40
SLC9A1 P19634 1/20 0.39
CYP2C19 P33261 2/20 0.37
CYP2A6 P11509 1/20 0.37
ALDH1A1 P00352 9/20 0.37
MAPT P10636 7/20 0.37
SMN1; SMN2 Q16637 4/20 0.37
RAB9A P51151 3/20 0.37
NPC1 O15118 2/20 0.37
PKM P14618 2/20 0.37
TP53 P04637 3/20 0.37
TDP1 Q9NUW8 2/20 0.37
BLM P54132 1/20 0.37
HPGD P15428 3/20 0.37
POLB P06746 2/20 0.37
MAPK1 P28482 2/20 0.37
HSD17B10 Q99714 2/20 0.37
ALOX15 P16050 1/20 0.37
NFKB1 P19838 1/20 0.37
NFKB2 Q00653 1/20 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
SCHEMBL4460428 0.82 SLC9A1 (0.47) LMNASLC9A1ALDH1A1MAPTSMN1; SMN2
SCHEMBL4323034 0.81 SLC9A1 (0.41) LMNASLC9A1CYP2C19ALDH1A1MAPT
SCHEMBL4335881 0.80 ALDH1A1 (0.46) LMNACYP2C19ALDH1A1MAPTSMN1; SMN2
SCHEMBL4335875 0.80 ALDH1A1 (0.46) LMNACYP2C19ALDH1A1MAPTSMN1; SMN2
SCHEMBL4334594 0.77 MAPT (0.46) LMNASLC9A1CYP2C19CYP2A6ALDH1A1
SCHEMBL4338974 0.77 MAPT (0.40) LMNASLC9A1ALDH1A1MAPTSMN1; SMN2
SCHEMBL4460430 0.72 MAPT (0.44) LMNASLC9A1ALDH1A1MAPTSMN1; SMN2
SCHEMBL13611608 0.72 MAPT (0.44) LMNASLC9A1ALDH1A1MAPTSMN1; SMN2
SCHEMBL4331909 0.69 CYP2A6 (0.43) LMNASLC9A1CYP2C19CYP2A6ALDH1A1
SCHEMBL4328924 0.68 SLC9A1 (0.42) LMNASLC9A1CYP2C19CYP2A6ALDH1A1

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-20090285849-A1 Thiosemicarbazones as anti-virals and immunopotentiators NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2009-11-19 US disclosed
US-7521062-B2 Thiosemicarbazones as anti-virals and immunopotentiators NOVARTIS VACCINES & DIAGNOSTICS, INC. (US) 2009-04-21 US disclosed
US-20050069555-A1 Thiosemicarbazones as anti-virals and immunopotentiators NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2005-03-31 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-20090285849-A1 Thiosemicarbazones as anti-virals and immunopotentiators MAVS, IRF3, HAVCR2 LMNA 4884/4885SLC9A1 1915/4885CYP2C19 2179/4885
US-20050069555-A1 Thiosemicarbazones as anti-virals and immunopotentiators MAVS, IRF3, HAVCR2 LMNA 4885/4885SLC9A1 1542/4885CYP2C19 2601/4885

“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.