SCHEMBL6970194

SCHEMBL6970194

CCOC(=O)CN1C(=O)CCN(C(=O)c2ccc([N+](=O)[O-])cc2)c2ccc(Cl)cc21

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.52
HTT P42858 2/20 0.48
USP2 O75604 1/20 0.48
SMN1; SMN2 Q16637 4/20 0.43
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
MGLL Q99685 1/20 0.42
ALDH1A1 P00352 4/20 0.42
MAPT P10636 2/20 0.41
TSHR P16473 1/20 0.41
GABRA2 P47869 1/20 0.41
GABRB2 P47870 1/20 0.41
POLB P06746 1/20 0.40
RAB9A P51151 2/20 0.40
KCNMA1 Q12791 1/20 0.40
ATM Q13315 1/20 0.39
DRD4 P21917 1/20 0.39
KCNJ1 P48048 1/20 0.39
KCNH2 Q12809 1/20 0.39

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
SCHEMBL6971802 0.91 SMN1; SMN2 (0.44) LMNASMN1; SMN2KMT2AMEN1ALDH1A1
SCHEMBL6969348 0.89 SMN1; SMN2 (0.45) LMNAHTTUSP2SMN1; SMN2KMT2A
SCHEMBL6962161 0.89 LMNA (0.49) LMNAHTTUSP2SMN1; SMN2KMT2A
SCHEMBL6964153 0.89 SMN1; SMN2 (0.46) LMNAHTTSMN1; SMN2KMT2AMEN1
SCHEMBL6955643 0.88 L3MBTL1 (0.46) SMN1; SMN2KMT2AMEN1ALDH1A1POLB
SCHEMBL6966483 0.87 SMN1; SMN2 (0.44) LMNASMN1; SMN2KMT2AMEN1ALDH1A1
SCHEMBL6969382 0.87 LMNA (0.55) LMNAHTTUSP2KMT2AMEN1
SCHEMBL6965972 0.87 SMN1; SMN2 (0.42) LMNASMN1; SMN2KMT2AMEN1MGLL
SCHEMBL6955924 0.87 LMNA (0.47) LMNAHTTUSP2KMT2AMEN1
SCHEMBL6960505 0.85 LMNA (0.52) LMNAHTTUSP2KMT2AMEN1

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-0620216-B1 Benzamide derivatives and their use as vasopressin antagonists FUJISAWA PHARMACEUTICAL CO (JP) 2003-01-08 EP disclosed
EP-0620216-A1 Benzamide derivatives and their use as vasopressin antagonists FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-10-19 EP disclosed