SCHEMBL657354

SCHEMBL657354

CCOC(=O)CCN(C(=O)Cc1ccc(Cl)cc1Cl)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.56
TSHR P16473 1/20 0.49
ALDH1A1 P00352 2/20 0.44
TP53 P04637 3/20 0.43
POLQ O75417 1/20 0.43
LMNA P02545 1/20 0.43
CYP3A4 P08684 2/20 0.41
CYP2C9 P11712 1/20 0.41
ERCC1 P07992 1/20 0.41
ERCC4 Q92889 1/20 0.41
ADCY8 P40145 1/20 0.41
GAA P10253 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
CCR5 P51681 1/20 0.40
ALOX5 P09917 1/20 0.40

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
SCHEMBL656749 0.86 ALDH1A1 (0.46) TSHRALDH1A1TP53POLQLMNA
SCHEMBL657395 0.83 SMN1; SMN2 (0.61) SMN1; SMN2TSHRTP53ALOX5
SCHEMBL657503 0.81 SMN1; SMN2 (0.57) SMN1; SMN2TSHRALDH1A1TP53LMNA
SCHEMBL707398 0.77 KMT2A (0.57) SMN1; SMN2ALDH1A1TP53LMNACYP3A4
SCHEMBL31441299 0.77 KMT2A (0.57) SMN1; SMN2ALDH1A1TP53LMNACYP3A4
SCHEMBL656732 0.77 CNR2 (0.58) SMN1; SMN2TSHRALDH1A1CYP3A4GAA
SCHEMBL657957 0.77 SMN1; SMN2 (0.66) SMN1; SMN2TP53TDP1ALOX5
SCHEMBL10900050 0.76 ALDH1A1 (0.45) SMN1; SMN2ALDH1A1TP53LMNACYP3A4
SCHEMBL21821644 0.76 SMN1; SMN2 (0.73) SMN1; SMN2TSHRALDH1A1TP53ALOX5
SCHEMBL6228355 0.75 SMN1; SMN2 (0.60) SMN1; SMN2TP53TDP1ALOX5

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
EP-2349999-B1 ALLOSTERIC PROTEIN KINASE MODULATORS UNIV SAARLAND (DE) 2016-01-27 EP disclosed
US-8912186-B2 Allosteric protein kinase modulators UNIVERSITAET DES SAARLANDES (DE) 2014-12-16 US disclosed
US-20120046307-A1 ALLOSTERIC PROTEIN KINASE MODULATORS UNIVERSITAET DES SAARLANDES (DE) 2012-02-23 US disclosed
EP-2177510-A1 Allosteric protein kinase modulators Universität des Saarlandes (DE) 2010-04-21 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 (1 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-20120046307-A1 ALLOSTERIC PROTEIN KINASE MODULATORS AURKC, AURKA, AURKB SMN1; SMN2 4389/4885TSHR 3221/4885ALDH1A1 4784/4885

“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.