SCHEMBL4975970

SCHEMBL4975970

O=S1(=O)CCN(Cc2ccc(Nc3nc(NC4CCOCC4)c4nc[nH]c4n3)c(Cl)c2)CC1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MERTK Q12866 2/20 0.43
CSF1R P07333 1/20 0.41
PLK4 O00444 2/20 0.40
NTRK1 P04629 2/20 0.40
LRRK2 Q5S007 1/20 0.38
FLT3 P36888 2/20 0.38
PDGFRA P16234 1/20 0.38
TTK P33981 11/20 0.38
EGFR P00533 1/20 0.38
PDE5A O76074 1/20 0.37
TYRO3 Q06418 1/20 0.36
GAS6 Q14393 1/20 0.36

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
SCHEMBL4977505 0.93 TTK (0.40) FLT3PDGFRATTKPDE5A
SCHEMBL4977877 0.92 CSF1R (0.49) MERTKCSF1RLRRK2FLT3PDGFRA
SCHEMBL4974126 0.91 TTK (0.45) MERTKCSF1RPLK4NTRK1LRRK2
SCHEMBL4766859 0.87 TTK (0.48) CSF1RLRRK2FLT3PDGFRATTK
SCHEMBL4766972 0.86 PLK4 (0.36) PLK4NTRK1LRRK2TTKEGFR
SCHEMBL4977265 0.86 TTK (0.49) MERTKCSF1RLRRK2FLT3PDGFRA
SCHEMBL4974257 0.85 MERTK (0.40) MERTKCSF1RPLK4NTRK1LRRK2
SCHEMBL4972483 0.83 TTK (0.46) MERTKTTK
SCHEMBL4979267 0.83 TTK (0.51) MERTKCSF1RLRRK2TTKTYRO3
SCHEMBL4979599 0.82 MERTK (0.51) MERTKCSF1RTTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120122840-A1 COMPOUNDS AND THERAPEUTIC USES THEREOF MYREXIS, INC. (US) 2012-05-17 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 (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-20120122840-A1 COMPOUNDS AND THERAPEUTIC USES THEREOF VHL, TP53, ASAH2 MERTK 1662/4885CSF1R 4296/4885PLK4 2263/4885

“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.