SCHEMBL14905952

SCHEMBL14905952

CCOC(=O)CCC(=O)N(CC=O)CCN(CC)CC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.39
APOBEC3A P31941 1/20 0.35
APOBEC3G Q9HC16 1/20 0.35
ALDH1A1 P00352 3/20 0.35
TRPA1 O75762 1/20 0.35
CYP1A2 P05177 1/20 0.35
LMNA P02545 3/20 0.35
TSHR P16473 3/20 0.35
POLB P06746 1/20 0.35
MGAM O43451 1/20 0.33
GAA P10253 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
NR1I2 O75469 1/20 0.33
PGR P06401 1/20 0.33
ADORA3 P0DMS8 1/20 0.33
PTGS2 P35354 1/20 0.33
PDE4D Q08499 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33

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
SCHEMBL15997242 0.85 LMNA (0.41) SMN1; SMN2ALDH1A1TRPA1CYP1A2LMNA
SCHEMBL17655562 0.84 SMN1; SMN2 (0.41) SMN1; SMN2ALDH1A1TRPA1CYP1A2LMNA
SCHEMBL15997195 0.83 SMN1; SMN2 (0.40) SMN1; SMN2ALDH1A1TRPA1CYP1A2LMNA
SCHEMBL22261569 0.75 ALDH1A1 (0.46) SMN1; SMN2APOBEC3AAPOBEC3GALDH1A1TRPA1
SCHEMBL9319516 0.74 ALDH1A1 (0.50) SMN1; SMN2APOBEC3AAPOBEC3GALDH1A1TRPA1
SCHEMBL15987580 0.74 CA12 (0.42) SMN1; SMN2ALDH1A1TRPA1CYP1A2LMNA
Hydrochloric Acid SCHEMBL11582693 0.73 ALDH1A1 (0.48) SMN1; SMN2APOBEC3AAPOBEC3GALDH1A1TRPA1
SCHEMBL15997231 0.71 SMN1; SMN2 (0.40) SMN1; SMN2ALDH1A1TRPA1CYP1A2LMNA
SCHEMBL10851453 0.71 APOBEC3A (0.56) SMN1; SMN2APOBEC3AAPOBEC3GALDH1A1TRPA1
SCHEMBL22269119 0.70 ALDH1A1 (0.42) SMN1; SMN2APOBEC3AAPOBEC3GALDH1A1TRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2772490-B1 AMINOALKYL-SUBSTITUTED N-THIENYL BENZAMIDE DERIVATIVE ASTELLAS PHARMA INC (JP) 2016-04-06 EP disclosed
EP-2772490-B1 AMINOALKYL-SUBSTITUTED N-THIENYL BENZAMIDE DERIVATIVE ASTELLAS PHARMA INC (JP) 2016-04-06 EP disclosed
US-9062032-B2 Aminoalkyl-substituted N-thienylbenzamide derivative ASTELLAS PHARMA INC. (JP) 2015-06-23 US disclosed
US-9062032-B2 Aminoalkyl-substituted N-thienylbenzamide derivative ASTELLAS PHARMA INC. (JP) 2015-06-23 US disclosed
US-9062032-B2 Aminoalkyl-substituted N-thienylbenzamide derivative ASTELLAS PHARMA INC. (JP) 2015-06-23 US disclosed
US-20150031727-A1 AMINOALKYL-SUBSTITUTED N-THIENYLBENZAMIDE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2015-01-29 US disclosed
US-20150031727-A1 AMINOALKYL-SUBSTITUTED N-THIENYLBENZAMIDE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2015-01-29 US disclosed
US-20150031727-A1 AMINOALKYL-SUBSTITUTED N-THIENYLBENZAMIDE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2015-01-29 US disclosed
EP-2772490-A1 AMINOALKYL-SUBSTITUTED N-THIENYL BENZAMIDE DERIVATIVE Astellas Pharma Inc. (JP) 2014-09-03 EP disclosed
WO-2013062065-A1 AMINOALKYL-SUBSTITUTED N-THIENYL BENZAMIDE DERIVATIVE アステラス製薬株式会社 (JP) 2013-05-02 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 (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-20150031727-A1 AMINOALKYL-SUBSTITUTED N-THIENYLBENZAMIDE DERIVATIVE SLC34A2, SLC10A2, ALPI SMN1; SMN2 4486/4885APOBEC3A 4581/4885APOBEC3G 4275/4885

“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.