SCHEMBL4780435

SCHEMBL4780435

CCOC(=O)Cc1csc(NC(=O)NCc2ccc(Cl)c(Cl)c2)n1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.64
MAPT P10636 7/20 0.62
SMN1; SMN2 Q16637 4/20 0.61
KDM4E B2RXH2 3/20 0.59
GAA P10253 2/20 0.59
ALOX12 P18054 1/20 0.59
TP53 P04637 1/20 0.59
MEN1 O00255 4/20 0.57
KMT2A Q03164 4/20 0.57
NPC1 O15118 2/20 0.57
ALDH1A1 P00352 1/20 0.57
POLB P06746 2/20 0.55
RAB9A P51151 2/20 0.55
MAPK1 P28482 1/20 0.54
HTT P42858 1/20 0.54

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
Urea SCHEMBL4776814 0.97 LMNA (0.60) LMNAMAPTSMN1; SMN2KDM4EGAA
SCHEMBL4781259 0.85 SCD (0.53) LMNAMAPTSMN1; SMN2GAAMEN1
SCHEMBL3651090 0.84 ROCK1 (0.47) RAB9AMAPK1
SCHEMBL354643 0.84 L3MBTL1 (0.59) LMNAMAPTSMN1; SMN2KDM4EGAA
SCHEMBL353373 0.83 ROCK1 (0.47) MAPTSMN1; SMN2MEN1KMT2AMAPK1
SCHEMBL4726379 0.83 TSHR (0.51) SMN1; SMN2MAPK1
SCHEMBL4727779 0.83 MAPT (0.64) LMNAMAPTSMN1; SMN2KDM4EGAA
SCHEMBL4780046 0.83 TSHR (0.46) LMNAMAPTSMN1; SMN2KDM4EGAA
SCHEMBL353214 0.83 ROCK1 (0.48) MAPTSMN1; SMN2MEN1KMT2AMAPK1
SCHEMBL353663 0.83 KMT2A (0.51) SMN1; SMN2KMT2AMAPK1

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-8716320-B2 Antibacteriall heterocyclic ureas REPLIDYNE, INC. (US) 2014-05-06 US disclosed
US-20080207703-A1 Antibacterial heterocyclic ureas REPLIDYNE, INC. (US) 2008-08-28 US disclosed
WO-2008011191-A1 ANTIBACTERIAL HETEROCYCLIC UREAS REPLIDYNE, INC. (US) 2008-01-24 WO 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-20080207703-A1 Antibacterial heterocyclic ureas UMPS, UROD, UGP2 LMNA 3271/4885MAPT 2119/4885SMN1; SMN2 4077/4885

“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.