SCHEMBL4336412

SCHEMBL4336412

COc1ccccc1-c1ccc(C=NNC(N)=S)o1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.64
KDM4E B2RXH2 7/20 0.64
MEN1 O00255 6/20 0.63
KMT2A Q03164 6/20 0.63
LMNA P02545 5/20 0.63
ALDH1A1 P00352 4/20 0.62
NPSR1 Q6W5P4 4/20 0.62
HPGD P15428 3/20 0.62
ALOX12 P18054 2/20 0.62
NPC1 O15118 1/20 0.57
RAB9A P51151 1/20 0.57
ATM Q13315 1/20 0.57
PKM P14618 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53

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
SCHEMBL4336410 1.00 MAPT (0.64) MAPTKDM4EMEN1KMT2ALMNA
SCHEMBL16063990 0.88 KDM4E (0.73) MAPTKDM4EMEN1KMT2ALMNA
SCHEMBL4459538 0.85 MEN1 (0.58) MAPTKDM4EMEN1KMT2ALMNA
SCHEMBL4459532 0.85 MEN1 (0.58) MAPTKDM4EMEN1KMT2ALMNA
SCHEMBL4324475 0.84 MAPT (0.73) MAPTKDM4EMEN1KMT2ALMNA
SCHEMBL4324469 0.84 MAPT (0.73) MAPTKDM4EMEN1KMT2ALMNA
SCHEMBL4334516 0.84 MAPT (0.67) MAPTKDM4EMEN1KMT2ALMNA
SCHEMBL4334511 0.84 MAPT (0.67) MAPTKDM4EMEN1KMT2ALMNA
SCHEMBL4336857 0.82 KDM4E (0.83) MAPTKDM4EMEN1KMT2ALMNA
SCHEMBL4336863 0.82 KDM4E (0.83) MAPTKDM4EMEN1KMT2ALMNA

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 MAPT 3619/4885KDM4E 3010/4885MEN1 4874/4885
US-20050069555-A1 Thiosemicarbazones as anti-virals and immunopotentiators MAVS, IRF3, HAVCR2 MAPT 3876/4885KDM4E 2338/4885MEN1 4872/4885

“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.