SCHEMBL2029708

SCHEMBL2029708

CC(=O)N1CC2(CC2)c2c([nH]c3cccc(F)c23)C1c1ccc(F)c(F)c1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 6/20 0.44
ABCG2 Q9UNQ0 6/20 0.44
KIF11 P52732 5/20 0.40
LMNA P02545 2/20 0.35
TP53 P04637 2/20 0.35
MAPT P10636 2/20 0.33
KDM4E B2RXH2 1/20 0.33
FEN1 P39748 1/20 0.32
HRH4 Q9H3N8 1/20 0.32

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
SCHEMBL2032812 0.90 KIF11 (0.42) ABCB1ABCG2KIF11LMNATP53
SCHEMBL997546 0.88 ABCG2 (0.53) ABCB1ABCG2KIF11LMNATP53
SCHEMBL2031231 0.85 ABCB1 (0.41) ABCB1ABCG2KIF11TP53MAPT
SCHEMBL2033734 0.85 KIF11 (0.35) ABCB1ABCG2KIF11TP53MAPT
SCHEMBL19596723 0.84 KIF11 (0.40) ABCB1ABCG2KIF11TP53MAPT
SCHEMBL2032523 0.83 ABCB1 (0.43) ABCB1ABCG2KIF11TP53MAPT
Ono-2952 SCHEMBL2032485 0.81 MAPT (0.39) ABCB1ABCG2KIF11TP53MAPT
Ono-2952 SCHEMBL2033676 0.81 MAPT (0.39) ABCB1ABCG2KIF11TP53MAPT
Ono-2952 SCHEMBL29613010 0.81 MAPT (0.39) ABCB1ABCG2KIF11TP53MAPT
SCHEMBL2034749 0.81 MAPKAPK2 (0.39) ABCB1ABCG2KIF11LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110207700-A1 TRICYCLIC COMPOUND AND USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2011-08-25 US claimed
US-20150105415-A1 TRICYCLIC COMPOUND AND USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2015-04-16 US disclosed
US-8952158-B2 Tricyclic compound and use thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2015-02-10 US disclosed
EP-1829874-B1 TRICYCLIC COMPOUND AND USE THEREOF ONO PHARMACEUTICAL CO (JP) 2014-02-12 EP disclosed
US-20130252993-A1 TRICYCLIC COMPOUND AND USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2013-09-26 US disclosed
US-8476293-B2 Tricyclic compound and use thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2013-07-02 US disclosed
US-20110207700-A1 TRICYCLIC COMPOUND AND USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2011-08-25 US disclosed
US-7964726-B2 1-(1,3-benzodioxol-5-yl)-N-(3,5-dimethylphenyl)-1,9-dihydrospiro[ beta -carboline-4,1'-cyclopropane]-2(3H)-carboxamide; mitochondrial benzodiazepine receptor modulator; digestive system disease caused by stress: irritable bowel syndrome, ulcerative colitis, or Crohn's disease ONO PHARMACEUTICAL CO., LTD. (JP) 2011-06-21 US disclosed
US-20080114012-A1 Tricyclic Compound And Use Thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2008-05-15 US disclosed
EP-1829874-A1 TRICYCLIC COMPOUND AND USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2007-09-05 EP 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 (4 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-20110207700-A1 TRICYCLIC COMPOUND AND USE THEREOF SI, ALPI, SLC10A2 ABCB1 90/4885ABCG2 265/4885KIF11 4657/4885
US-20150105415-A1 TRICYCLIC COMPOUND AND USE THEREOF SI, ALPI, SLC10A2 ABCB1 90/4885ABCG2 265/4885KIF11 4657/4885
US-20130252993-A1 TRICYCLIC COMPOUND AND USE THEREOF SI, ALPI, SLC10A2 ABCB1 90/4885ABCG2 265/4885KIF11 4657/4885
US-20080114012-A1 Tricyclic Compound And Use Thereof SI, ALPI, SLC10A2 ABCB1 97/4885ABCG2 264/4885KIF11 4674/4885

“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.