SCHEMBL1337675

SCHEMBL1337675

Nc1c(F)cc(-c2cccc(OC3CC3)c2)cc1F

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 3/20 0.49
FFAR4 Q5NUL3 1/20 0.47
ENPP2 Q13822 1/20 0.40
SLC6A2 P23975 4/20 0.40
SLC6A3 Q01959 4/20 0.40
SLC6A4 P31645 3/20 0.40
IGF1R P08069 2/20 0.37
SLC16A3 O15427 1/20 0.36
SLC16A1 P53985 1/20 0.36
EPHX2 P34913 1/20 0.36

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
SCHEMBL1336643 0.94 FFAR4 (0.51) DHODHFFAR4ENPP2SLC6A2SLC6A3
SCHEMBL1337890 0.86 DHODH (0.46) DHODHFFAR4ENPP2SLC6A2SLC6A3
SCHEMBL1336585 0.85 FFAR4 (0.47) DHODHFFAR4SLC6A2SLC6A3SLC6A4
SCHEMBL17027769 0.81 DHODH (0.47) DHODHFFAR4SLC6A2SLC6A3SLC6A4
SCHEMBL16334746 0.81 FFAR4 (0.56) DHODHFFAR4ENPP2SLC6A2SLC6A3
SCHEMBL2595252 0.80 SLC6A2 (0.55) DHODHFFAR4ENPP2SLC6A2SLC6A3
SCHEMBL1337871 0.80 SLC6A2 (0.50) DHODHFFAR4SLC6A2SLC6A3SLC6A4
SCHEMBL18519062 0.77 PTGS1 (0.36) FFAR4SLC6A2SLC6A3SLC6A4EPHX2
SCHEMBL1335522 0.77 CYP3A4 (0.55) DHODH
SCHEMBL1337634 0.76 TP53 (0.54) DHODH

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-9758474-B2 Immunomodulator and anti-inflammatory compounds INCOZEN THERAPEUTICS PVT. LTD. (IN) 2017-09-12 US disclosed
US-20140220050-A1 NOVEL IMMUNOMODULATOR AND ANTI-INFLAMMATORY COMPOUNDS INCOZEN THERAPEUTICS PVT. LTD. (CH) 2014-08-07 US disclosed
US-20110275603-A1 NOVEL IMMUNOMODULATOR AND ANTI-INFLAMMATORY COMPOUNDS RHIZEN PHARMACEUTICALS SA (FR) 2011-11-10 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-20140220050-A1 NOVEL IMMUNOMODULATOR AND ANTI-INFLAMMATORY COMPOUNDS DHODH, DLD, DHFR DHODH 1/4885FFAR4 1678/4885ENPP2 794/4885
US-20110275603-A1 NOVEL IMMUNOMODULATOR AND ANTI-INFLAMMATORY COMPOUNDS DHODH, DLD, DHFR DHODH 1/4885FFAR4 1678/4885ENPP2 794/4885

“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.