SCHEMBL6919703

SCHEMBL6919703

Cc1ccc2c(c1)c1c(n2CC(CC(=O)O)c2ccc(F)cc2F)CC2CCC1N2C

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 3/20 0.39
PTGDR2 Q9Y5Y4 7/20 0.35
PER2 O15055 2/20 0.35
CRY2 Q49AN0 1/20 0.35
KDM4E B2RXH2 2/20 0.34
POLB P06746 1/20 0.34
HSD17B10 Q99714 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
KMT2A Q03164 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
MCHR1 Q99705 1/20 0.33

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
SCHEMBL6921928 0.92 HTR6 (0.36) HTR6PTGDR2PER2CRY2KDM4E
SCHEMBL15087615 0.91 RXFP1 (0.36) HTR6PTGDR2PER2CRY2KDM4E
SCHEMBL6922085 0.91 HSD17B10 (0.38) HTR6PER2CRY2KDM4EHSD17B10
SCHEMBL14729237 0.91 HTR6 (0.41) HTR6PTGDR2PER2KDM4EKMT2A
SCHEMBL6919940 0.90 HTR6 (0.40) HTR6PTGDR2PER2CRY2KDM4E
SCHEMBL6921538 0.83 HTR6 (0.40) HTR6PTGDR2KDM4EPOLBHSD17B10
SCHEMBL14729249 0.82 HTR6 (0.37) HTR6PTGDR2PER2CRY2KDM4E
SCHEMBL6922002 0.81 HTR6 (0.37) HTR6PTGDR2PER2CRY2KDM4E
SCHEMBL6920232 0.81 HTR6 (0.36) HTR6PTGDR2PER2CRY2KDM4E
SCHEMBL6920891 0.80 HTR6 (0.36) HTR6PTGDR2PER2CRY2HSD17B10

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 7 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-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-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
US-20130172366-A1 BRIDGED HETEROCYCLIC COMPOUNDS AND METHODS OF USE MEDIVATION TECHNOLOGIES, INC. 2013-07-04 US disclosed
WO-2011038164-A1 BRIDGED HETEROCYCLIC COMPOUNDS AND METHODS OF USE MEDIVATION TECHNOLOGIES, INC. (US) 2011-03-31 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 (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 22/4885PTGDR2 114/4885PER2 3609/4885
US-20130172366-A1 BRIDGED HETEROCYCLIC COMPOUNDS AND METHODS OF USE HRH4, HNMT, HTR2C HTR6 22/4885PTGDR2 114/4885PER2 3609/4885

“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.