SCHEMBL1483140

SCHEMBL1483140

O=C(O)CCCOc1ccc(-c2ccc(/C=C/c3nc(-c4ccc(Cl)cc4Cl)cn3CC(=O)NCc3ccc(F)cc3)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 8/20 0.47
SMN1; SMN2 Q16637 1/20 0.43
RXFP1 Q9HBX9 1/20 0.40
MEN1 O00255 1/20 0.39
RECQL P46063 1/20 0.39
KMT2A Q03164 1/20 0.39
CYSLTR2 Q9NS75 1/20 0.38
CYSLTR1 Q9Y271 1/20 0.38
PLA2G7 Q13093 1/20 0.38
ALDH1A1 P00352 2/20 0.37
TP53 P04637 1/20 0.37
MMP13 P45452 1/20 0.37
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
GRIN2B Q13224 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
SCHEMBL1481966 1.00 CNR1 (0.47) CNR1SMN1; SMN2RXFP1MEN1RECQL
SCHEMBL1480553 0.93 CNR1 (0.46) CNR1SMN1; SMN2RXFP1MEN1RECQL
SCHEMBL1480548 0.93 CNR1 (0.46) CNR1SMN1; SMN2RXFP1MEN1RECQL
SCHEMBL1480569 0.93 CNR1 (0.51) CNR1MEN1KMT2ACYSLTR2CYSLTR1
SCHEMBL1480567 0.93 CNR1 (0.51) CNR1MEN1KMT2ACYSLTR2CYSLTR1
SCHEMBL1481318 0.93 FFAR4 (0.43) CNR1MEN1RECQLKMT2ACYSLTR2
SCHEMBL1481314 0.93 FFAR4 (0.43) CNR1MEN1RECQLKMT2ACYSLTR2
SCHEMBL1480597 0.89 HPGD (0.42) CNR1CYSLTR2CYSLTR1ALDH1A1RAB9A
SCHEMBL1480592 0.89 HPGD (0.42) CNR1CYSLTR2CYSLTR1ALDH1A1RAB9A
SCHEMBL1481105 0.88 CNR1 (0.51) CNR1MEN1RECQLKMT2AALDH1A1

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 6 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
EP-1594847-A2 SUBSTITUTED AZOLE DERIVATIVES AS THERAPEUTIC AGENTS Transtech Pharma, Inc. (US) 2005-11-16 EP 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 CNR1 3369/4885SMN1; SMN2 4575/4885RXFP1 3571/4885
US-20110077399-A1 Substituted Azole Derivatives as Therapeutic Agents PTPRS, PTPRO, PTPRJ CNR1 3369/4885SMN1; SMN2 4575/4885RXFP1 3571/4885

“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.