SCHEMBL7108855

SCHEMBL7108855

CCOC(=O)c1cn(Cc2cc(C#N)ccc2OC)cc1Cc1ccc(C#N)cc1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 2/20 0.43
MAPT P10636 4/20 0.41
TDP1 Q9NUW8 2/20 0.41
LMNA P02545 6/20 0.41
SMN1; SMN2 Q16637 5/20 0.41
TSHR P16473 2/20 0.41
MAPK1 P28482 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
GAA P10253 1/20 0.40
PTGS1 P23219 1/20 0.39
PTGS2 P35354 1/20 0.39
FNTA P49354 1/20 0.38
FNTB P49356 1/20 0.38
CNR1 P21554 3/20 0.38
ELANE P08246 1/20 0.38

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
SCHEMBL7101820 0.88 PTGS1 (0.44) MAPTTDP1LMNASMN1; SMN2TSHR
SCHEMBL6166501 0.86 MAPT (0.47) MAPTTDP1LMNASMN1; SMN2TSHR
SCHEMBL6163869 0.84 POLB (0.45) MAPTTDP1LMNASMN1; SMN2TSHR
SCHEMBL6170882 0.84 MAPT (0.45) MAPTTDP1LMNASMN1; SMN2TSHR
SCHEMBL6164731 0.83 TSHR (0.45) MAPTTDP1LMNASMN1; SMN2TSHR
SCHEMBL6163697 0.83 TSHR (0.45) MAPTTDP1LMNASMN1; SMN2TSHR
SCHEMBL7105719 0.81 POLB (0.47) SMN1; SMN2TSHRPTGS1PTGS2ELANE
SCHEMBL6163207 0.79 TSHR (0.46) LMNATSHRPTGS1PTGS2ELANE
SCHEMBL7108857 0.79 POLB (0.46) SMN1; SMN2TSHRPTGS1PTGS2ELANE
SCHEMBL7106357 0.78 SMN1; SMN2 (0.41) MAPTTDP1LMNASMN1; SMN2TSHR

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-20030065176-A1 Factor xa inhibitors with aryl-amidines and derivatives, and prodrugs thereof LG CHEM INVESTMENT LTD. (KR) 2003-04-03 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-20030065176-A1 Factor xa inhibitors with aryl-amidines and derivatives, and prodrugs thereof F2, F12, TFPI PDE5A 388/4885MAPT 4356/4885TDP1 1302/4885

“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.