SCHEMBL13675366

SCHEMBL13675366

CCc1ccccc1-c1ccc(C(F)(F)F)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 3/20 0.50
FFAR1 O14842 1/20 0.48
FFAR4 Q5NUL3 1/20 0.48
TACR1 P25103 3/20 0.47
BACE1 P56817 2/20 0.45
PTPN5 P54829 1/20 0.42
MAOB P27338 1/20 0.42
TRPA1 O75762 1/20 0.42
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
PPARG P37231 1/20 0.41
PPARA Q07869 1/20 0.41
GAA P10253 1/20 0.41
PDK2 Q15119 1/20 0.41
PSEN1 P49768 1/20 0.41
PSEN2 P49810 1/20 0.41
APH1B Q8WW43 1/20 0.41
NCSTN Q92542 1/20 0.41
APH1A Q96BI3 1/20 0.41
PSENEN Q9NZ42 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
SCHEMBL13699902 0.84 PDCD1 (0.46) KIF11FFAR1FFAR4TACR1BACE1
SCHEMBL5198493 0.83 PDK2 (0.53) KIF11FFAR1FFAR4TACR1BACE1
SCHEMBL13814945 0.83 NPC1 (0.43) KIF11TRPA1ALDH1A1PPARGPPARA
SCHEMBL11994127 0.83 ADORA3 (0.45) KIF11FFAR1FFAR4TACR1BACE1
SCHEMBL18014699 0.82 KIF11 (0.47) KIF11FFAR1FFAR4TACR1BACE1
SCHEMBL5511135 0.81 KIF11 (0.50) KIF11FFAR1FFAR4TACR1BACE1
SCHEMBL2096005 0.81 KIF11 (0.50) KIF11FFAR1FFAR4TACR1BACE1
SCHEMBL9295043 0.81 DPP4 (0.62) KIF11FFAR1FFAR4TACR1BACE1
SCHEMBL5199432 0.81 KIF11 (0.50) KIF11FFAR1FFAR4TACR1BACE1
SCHEMBL792034 0.81 TACR1 (0.52) KIF11FFAR1FFAR4TACR1BACE1

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
EP-3052495-B1 NOVEL BICYCLIC PYRIDINONES AS GAMMA-SECRETASE MODULATORS PFIZER (US) 2019-06-26 EP disclosed
US-20160229847-A1 NOVEL BICYCLIC PYRIDINONES AS GAMMA-SECRETASE MODULATORS PFIZER (US) 2016-08-11 US disclosed
US-20090270381-A1 Non-steroidal progesterone receptor modulators BAYER SCHERING PHARMA AG (DE) 2009-10-29 US disclosed
WO-2009077186-A1 NONSTEROIDAL PROGESTERONE RECEPTOR MODULATORS BAYER SCHERING PHARMA AKTIENGESLLSCHAFT (DE) 2009-06-25 WO disclosed
EP-2070909-A1 Non-steroidal progesterone receptor modulators Bayer Schering Pharma AG (DE) 2009-06-17 EP disclosed
US-20090075989-A1 NON-STEROIDAL PROGESTERONE RECEPTOR MODULATORS BAYER SCHERING PHARMA AG (DE) 2009-03-19 US disclosed
WO-2008077646-A1 NON-STEROIDAL PROGESTERONE RECEPTOR MODULATORS BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-07-03 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 (3 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-20090270381-A1 Non-steroidal progesterone receptor modulators PGR, PGRMC1, PGRMC2 KIF11 3580/4885FFAR1 178/4885FFAR4 317/4885
US-20160229847-A1 NOVEL BICYCLIC PYRIDINONES AS GAMMA-SECRETASE MODULATORS BACE1, BACE2, PSEN2 KIF11 4539/4885FFAR1 2534/4885FFAR4 2771/4885
US-20090075989-A1 NON-STEROIDAL PROGESTERONE RECEPTOR MODULATORS NR5A1, CYP19A1, GPER1 KIF11 3486/4885FFAR1 131/4885FFAR4 453/4885

“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.