SCHEMBL5445899

SCHEMBL5445899

Cc1ccc2c(c1)c1c(n2CC(=O)O)C(NC(C)c2ccccc2)CCC1

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.51
MAPK1 P28482 2/20 0.51
NPSR1 Q6W5P4 2/20 0.51
PTGDR2 Q9Y5Y4 5/20 0.47
HSD17B10 Q99714 4/20 0.45
USP2 O75604 2/20 0.45
PAX8 Q06710 1/20 0.43
KDM4E B2RXH2 5/20 0.43
GAA P10253 1/20 0.43
PTGDR Q13258 1/20 0.43
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
YAP1 P46937 1/20 0.43
TEAD4 Q15561 1/20 0.43
ALDH1A1 P00352 1/20 0.42
ALOX15 P16050 1/20 0.42
TSHR P16473 1/20 0.42
GLA P06280 1/20 0.42
AKR1B1 P15121 1/20 0.41
CYP2D6 P10635 1/20 0.41

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
SCHEMBL13576545 0.92 HSD17B10 (0.55) MAPTMAPK1NPSR1PTGDR2HSD17B10
SCHEMBL24113836 0.73 HSD17B10 (0.62) MAPK1NPSR1PTGDR2HSD17B10KDM4E
SCHEMBL24113859 0.73 HSD17B10 (0.62) MAPK1NPSR1PTGDR2HSD17B10KDM4E
SCHEMBL2810407 0.70 PTGDR2 (0.51) PTGDR2HSD17B10PAX8KDM4EGAA
Hydrochloric Acid SCHEMBL4369870 0.70 CYP2D6 (0.47) MAPK1HSD17B10USP2KDM4EGAA
SCHEMBL831286 0.70 KDM4E (0.48) MAPTMAPK1NPSR1PTGDR2HSD17B10
SCHEMBL4195673 0.70 CYP2D6 (0.78) MAPTGAAKMT2AMEN1ALOX15
SCHEMBL4199294 0.70 CYP2D6 (0.78) MAPTGAAKMT2AMEN1ALOX15
SCHEMBL20537339 0.70 CYP2D6 (0.78) MAPTGAAKMT2AMEN1ALOX15
SCHEMBL20537338 0.70 CYP2D6 (0.78) MAPTGAAKMT2AMEN1ALOX15

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-20070276009-A1 Compositions and Methods for Viral Inhibition CHIRON CORPORATION 2007-11-29 US disclosed
US-20070276009-A1 Compositions and Methods for Viral Inhibition CHIRON CORPORATION 2007-11-29 US disclosed
US-20070276009-A1 Compositions and Methods for Viral Inhibition CHIRON CORPORATION 2007-11-29 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-20070276009-A1 Compositions and Methods for Viral Inhibition MAVS, SARS1, ZC3HAV1 MAPT 3817/4885MAPK1 4431/4885NPSR1 3303/4885

“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.