SCHEMBL1363736

SCHEMBL1363736

CCc1c(F)ccc(C#N)c1Cl

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
AR P10275 12/20 0.44
CYP11B1 P15538 1/20 0.37
CYP11B2 P19099 1/20 0.37
TRPV4 Q9HBA0 1/20 0.36
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
HTR2B P41595 1/20 0.34
ESR1 P03372 1/20 0.33
ESR2 Q92731 1/20 0.33
ALDH1A1 P00352 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33
TDP1 Q9NUW8 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
SCHEMBL221854 0.86 AR (0.42) ARCYP11B1CYP11B2TRPV4HTR2A
SCHEMBL10878832 0.84 AR (0.45) ARTRPV4HTR2AHTR2CHTR2B
SCHEMBL28573127 0.82 TRPV4 (0.39) ARCYP11B1CYP11B2TRPV4TDP1
SCHEMBL3333067 0.81 AR (0.41) ARCYP11B1CYP11B2TRPV4ESR1
Threonine SCHEMBL3408904 0.80 AR (0.35) AR
SCHEMBL1365870 0.79 AR (0.36) ARCYP11B1CYP11B2TRPV4HTR2A
SCHEMBL1363872 0.79 AR (0.39) ARCYP11B1CYP11B2TRPV4ESR1
SCHEMBL12342668 0.78 TRPV4 (0.36) ARCYP11B1CYP11B2TRPV4TDP1
SCHEMBL18704482 0.78 AR (0.41) ARTRPV4HTR2AHTR2CHTR2B
SCHEMBL91338 0.78 P2RX7 (0.37) HTR2AHTR2CHTR2BALDH1A1TDP1

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 46 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2766350-B1 SELECTIVE ANDROGEN RECEPTOR MODULATORS LILLY CO ELI (US) 2017-04-05 EP disclosed
EP-2766350-B1 SELECTIVE ANDROGEN RECEPTOR MODULATORS LILLY CO ELI (US) 2017-04-05 EP disclosed
EP-2766350-A1 SELECTIVE ANDROGEN RECEPTOR MODULATORS Eli Lilly and Company (US) 2014-08-20 EP disclosed
EP-2260028-B1 SELECTIVE ANDROGEN RECEPTOR MODULATORS RADIUS HEALTH INC (US) 2014-05-07 EP disclosed
EP-2260028-B1 SELECTIVE ANDROGEN RECEPTOR MODULATORS RADIUS HEALTH INC (US) 2014-05-07 EP disclosed
US-8658693-B2 4-aminobenzonitrile selective androgen receptor modulators ELI LILLY AND COMPANY (US) 2014-02-25 US disclosed
US-8658693-B2 4-aminobenzonitrile selective androgen receptor modulators ELI LILLY AND COMPANY (US) 2014-02-25 US disclosed
US-8658693-B2 4-aminobenzonitrile selective androgen receptor modulators ELI LILLY AND COMPANY (US) 2014-02-25 US disclosed
US-8629167-B2 Selective androgen receptor modulators RADIUS HEALTH, INC. (US) 2014-01-14 US disclosed
US-8629167-B2 Selective androgen receptor modulators RADIUS HEALTH, INC. (US) 2014-01-14 US disclosed
US-20100041721-A1 SELECTIVE ANDROGEN RECEPTOR MODULATORS RADIUS HEALTH, INC. (US) 2010-02-18 US disclosed
US-20100041721-A1 SELECTIVE ANDROGEN RECEPTOR MODULATORS RADIUS HEALTH, INC. (US) 2010-02-18 US disclosed
US-20100041721-A1 SELECTIVE ANDROGEN RECEPTOR MODULATORS RADIUS HEALTH, INC. (US) 2010-02-18 US disclosed
US-20090253758-A1 Selective androgen receptor modulators ELLIPSES PHARMA LTD (GB) 2009-10-08 US disclosed
US-20090253758-A1 Selective androgen receptor modulators ELLIPSES PHARMA LTD (GB) 2009-10-08 US disclosed
US-20090253758-A1 Selective androgen receptor modulators ELLIPSES PHARMA LTD (GB) 2009-10-08 US disclosed
WO-2009105214-A2 SELECTIVE ANDROGEN RECEPTOR MODULATORS RADIUS HEALTH, INC. (US) 2009-08-27 WO disclosed
WO-2009105214-A2 SELECTIVE ANDROGEN RECEPTOR MODULATORS RADIUS HEALTH, INC. (US) 2009-08-27 WO disclosed
EP-1911743-A1 CYCLIC AMINE COMPOUND Takeda Pharmaceutical Company Limited (JP) 2008-04-16 EP disclosed
EP-1911743-A1 CYCLIC AMINE COMPOUND Takeda Pharmaceutical Company Limited (JP) 2008-04-16 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 (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-20100041721-A1 SELECTIVE ANDROGEN RECEPTOR MODULATORS AR, SHBG, IGF1R AR 1/4885CYP11B1 39/4885CYP11B2 29/4885
US-20090253758-A1 Selective androgen receptor modulators AR, SHBG, GPR119 AR 1/4885CYP11B1 41/4885CYP11B2 26/4885

“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.