SCHEMBL7360908

SCHEMBL7360908

O=C(Nc1ccc(Cl)nc1)c1ccccc1NC(=O)C1CCN(c2ccncc2)CC1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
F10 P00742 13/20 0.51
F2 P00734 3/20 0.48
LMNA P02545 1/20 0.48
TP53 P04637 1/20 0.48
GAA P10253 1/20 0.48
TSHR P16473 1/20 0.48
PTBP1 P26599 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
ELANE P08246 1/20 0.47
ALDH1A1 P00352 1/20 0.47
KDM4E B2RXH2 1/20 0.47
EGFR P00533 1/20 0.47
RXFP1 Q9HBX9 1/20 0.46

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
Hydrochloric Acid SCHEMBL6107967 0.99 F10 (0.50) F10F2LMNATP53GAA
Hydrochloric Acid SCHEMBL5225021 0.87 F10 (0.55) F10F2LMNASMN1; SMN2ALDH1A1
Hydrochloric Acid SCHEMBL5225771 0.85 F10 (0.56) F10F2TSHRELANEALDH1A1
Hydrochloric Acid SCHEMBL5221061 0.85 ME3 (0.59) F10F2ELANEKDM4ERXFP1
SCHEMBL6109086 0.85 F10 (0.50) F10F2TP53ELANEKDM4E
SCHEMBL6106118 0.84 BDKRB1 (0.48) F10F2LMNAELANEKDM4E
Hydrochloric Acid SCHEMBL5223873 0.83 KDM4E (0.51) F10F2TP53GAASMN1; SMN2
Hydrochloric Acid SCHEMBL5223652 0.83 F10 (0.55) F10F2ELANEKDM4ERXFP1
Hydrochloric Acid SCHEMBL6108323 0.83 BDKRB1 (0.47) F10F2LMNAELANEKDM4E
Hydrochloric Acid SCHEMBL5224177 0.83 F10 (0.57) F10F2ELANERXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1140903-A1 AROMATIC AMIDES ELI LILLY AND COMPANY (US) 2001-10-10 EP disclosed
WO-2000039118-A1 AROMATIC AMIDES ELI LILLY AND COMPANY (US) 2000-07-06 WO disclosed