SCHEMBL15086096

SCHEMBL15086096

Cc1ccc2c(c1)c1c(n2CC(CC(=O)CO)C(=O)N(C)C)CC2CCC1N2C

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 6/20 0.38
KDM4E B2RXH2 3/20 0.33
PTGDR2 Q9Y5Y4 2/20 0.33
KMT2A Q03164 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
MAPK1 P28482 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
HSD17B10 Q99714 1/20 0.31
MCHR1 Q99705 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31
NTSR1 P30989 1/20 0.31
HTT P42858 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL6919689 0.91 HTR6 (0.41) HTR6KDM4EPTGDR2KMT2ANPSR1
SCHEMBL15087612 0.89 HSD17B10 (0.40) HTR6KDM4EPTGDR2KMT2ANPSR1
SCHEMBL13394868 0.81 HTR6 (0.44) HTR6KDM4EPTGDR2L3MBTL1HSD17B10
SCHEMBL15290455 0.77 HTR6 (0.44) HTR6KDM4EPTGDR2KMT2AMAPK1
SCHEMBL15290217 0.77 HTR6 (0.41) HTR6KDM4EPTGDR2KMT2ANPSR1
SCHEMBL6919680 0.77 HTR6 (0.38) HTR6KDM4EKMT2ANPSR1MAPK1
SCHEMBL6922002 0.76 HTR6 (0.37) HTR6KDM4EPTGDR2KMT2ANPSR1
SCHEMBL6920035 0.76 HTR6 (0.37) HTR6KDM4EPTGDR2KMT2ANPSR1
SCHEMBL14944926 0.76 GRIN2B (0.47) HTR6KDM4EKMT2AMAPK1TDP1
SCHEMBL6919842 0.75 HTR6 (0.41) HTR6KDM4EPTGDR2KMT2ANPSR1

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-9006234-B2 Bridged heterocyclic compounds and methods of use MEDIVATION TECHNOLOGIES, INC. (US) 2015-04-14 US disclosed
US-20130190359-A1 BRIDGED HETEROCYCLIC COMPOUNDS AND METHODS OF USE MEDIVATION TECHNOLOGIES, INC. (US) 2013-07-25 US disclosed
US-20130172366-A1 BRIDGED HETEROCYCLIC COMPOUNDS AND METHODS OF USE MEDIVATION TECHNOLOGIES, INC. 2013-07-04 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-20130190359-A1 BRIDGED HETEROCYCLIC COMPOUNDS AND METHODS OF USE HRH4, HNMT, HTR2C HTR6 22/4885KDM4E 2470/4885PTGDR2 114/4885
US-20130172366-A1 BRIDGED HETEROCYCLIC COMPOUNDS AND METHODS OF USE HRH4, HNMT, HTR2C HTR6 22/4885KDM4E 2470/4885PTGDR2 114/4885

“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.