SCHEMBL1481091

SCHEMBL1481091

COC(=O)Cn1cc(-c2ccc(Cl)cc2Cl)nc1C=Cc1ccc(-c2ccc(O)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
POLB P06746 1/20 0.38
PTGS2 P35354 2/20 0.36
ALPL P05186 2/20 0.36
PTGS1 P23219 1/20 0.36
BACE1 P56817 1/20 0.36
EGFR P00533 1/20 0.36
CYP3A4 P08684 1/20 0.36
DPP4 P27487 1/20 0.36
DPP8 Q6V1X1 1/20 0.36
DPP9 Q86TI2 1/20 0.36
CNR1 P21554 3/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
KCNA3 P22001 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
SCHEMBL1481089 1.00 MAPT (0.40) MAPTMEN1KMT2ASMN1; SMN2POLB
SCHEMBL1484270 0.89 MAPT (0.39) MAPTPOLBPTGS2ALPLCYP3A4
SCHEMBL1483135 0.89 SMN1; SMN2 (0.42) MAPTMEN1KMT2ASMN1; SMN2PTGS2
SCHEMBL1483138 0.89 SMN1; SMN2 (0.42) MAPTMEN1KMT2ASMN1; SMN2PTGS2
SCHEMBL1480644 0.85 MEN1 (0.45) MAPTMEN1KMT2ASMN1; SMN2PTGS2
SCHEMBL1480642 0.85 MEN1 (0.45) MAPTMEN1KMT2ASMN1; SMN2PTGS2
SCHEMBL1676512 0.85 DRD2 (0.48) MAPTMEN1KMT2ASMN1; SMN2POLB
SCHEMBL1676516 0.85 DRD2 (0.48) MAPTMEN1KMT2ASMN1; SMN2POLB
SCHEMBL1481859 0.84 CNR1 (0.56) MAPTMEN1KMT2ACNR1KDM4E
SCHEMBL1481855 0.84 CNR1 (0.56) MAPTMEN1KMT2ACNR1KDM4E

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 5 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
EP-1594847-A2 SUBSTITUTED AZOLE DERIVATIVES AS THERAPEUTIC AGENTS Transtech Pharma, Inc. (US) 2005-11-16 EP disclosed
WO-2004071447-A9 SUBSTITUTED AZOLE DERIVATIVES AS THERAPEUTIC AGENTS TRANSTECH PHARMA INC (US) 2005-10-13 WO disclosed
US-20040192743-A1 Substituted azole derivatives as therapeutic agents TRANSTECH PHARMA, INC. 2004-09-30 US disclosed
WO-2004071447-A2 SUBSTITUTED AZOLE DERIVATIVES AS THERAPEUTIC AGENTS TRANSTECH PHARMA INC. (US) 2004-08-26 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 (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 MAPT 3558/4885MEN1 3467/4885KMT2A 1996/4885
US-20110077399-A1 Substituted Azole Derivatives as Therapeutic Agents PTPRS, PTPRO, PTPRJ MAPT 3558/4885MEN1 3467/4885KMT2A 1996/4885

“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.