SCHEMBL1481871

SCHEMBL1481871

CCn1cc(-c2ccc(Cl)cc2Cl)nc1/C=C/c1ccc(-c2ccc(OCCCC(=O)O)cc2)cc1F

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 12/20 0.42
FFAR1 O14842 8/20 0.42
CYP2C9 P11712 1/20 0.40
SCN5A Q14524 1/20 0.40
MIF P14174 2/20 0.39
DHODH Q02127 1/20 0.38
RARA P10276 1/20 0.37
RARB P10826 1/20 0.37
AGER Q15109 1/20 0.37
CNR1 P21554 2/20 0.36
PDE3B Q13370 1/20 0.35
PDE3A Q14432 1/20 0.35
P2RY12 Q9H244 1/20 0.35

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
SCHEMBL1481872 1.00 FFAR4 (0.42) FFAR4FFAR1CYP2C9SCN5AMIF
SCHEMBL1482188 0.95 FFAR4 (0.43) FFAR4FFAR1CYP2C9SCN5AMIF
SCHEMBL1482184 0.95 FFAR4 (0.43) FFAR4FFAR1CYP2C9SCN5AMIF
SCHEMBL1481082 0.93 FFAR4 (0.39) FFAR4FFAR1MIF
SCHEMBL1481086 0.93 FFAR4 (0.39) FFAR4FFAR1MIF
SCHEMBL1481072 0.93 MAPT (0.39) FFAR4FFAR1DHODHRARARARB
SCHEMBL1481076 0.93 MAPT (0.39) FFAR4FFAR1DHODHRARARARB
SCHEMBL1481594 0.89 FFAR4 (0.44) FFAR4FFAR1CYP2C9SCN5ADHODH
SCHEMBL1481591 0.89 FFAR4 (0.44) FFAR4FFAR1CYP2C9SCN5ADHODH
SCHEMBL1480691 0.89 MAPT (0.39) FFAR4FFAR1DHODHCNR1PDE3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110077399-A1 Substituted Azole Derivatives as Therapeutic Agents TRANSTECH PHARMA, INC. (US) 2011-03-31 US disclosed
US-20110077399-A1 Substituted Azole Derivatives as Therapeutic Agents TRANSTECH PHARMA, INC. (US) 2011-03-31 US disclosed
US-20110077399-A1 Substituted Azole Derivatives as Therapeutic Agents TRANSTECH PHARMA, INC. (US) 2011-03-31 US disclosed
US-20040192743-A1 Substituted azole derivatives as therapeutic agents TRANSTECH PHARMA, INC. 2004-09-30 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-20040192743-A1 Substituted azole derivatives as therapeutic agents PTPRS, PTPRO, PTPRJ FFAR4 2604/4885FFAR1 1810/4885CYP2C9 704/4885
US-20110077399-A1 Substituted Azole Derivatives as Therapeutic Agents PTPRS, PTPRO, PTPRJ FFAR4 2604/4885FFAR1 1810/4885CYP2C9 704/4885

“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.