SCHEMBL7228347

SCHEMBL7228347

COc1cc(NC(=O)Cc2ccc(F)c(F)c2)ccc1/C=N/NC(=O)c1ccc(O)c(Cl)c1

nearest known ligand 0.69

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GCGR P47871 17/20 0.69
ADCYAP1R1 P41586 3/20 0.49
KDM4E B2RXH2 1/20 0.49
ALDH1A1 P00352 1/20 0.49
MAPT P10636 1/20 0.49
RAB9A P51151 1/20 0.49
BLM P54132 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
CTDSP1 Q9GZU7 1/20 0.49

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
SCHEMBL7228351 1.00 GCGR (0.69) GCGRADCYAP1R1KDM4EALDH1A1MAPT
SCHEMBL2646988 0.92 GCGR (0.80) GCGRADCYAP1R1KDM4EALDH1A1MAPT
SCHEMBL2646990 0.92 GCGR (0.80) GCGRADCYAP1R1KDM4EALDH1A1MAPT
SCHEMBL9071651 0.90 GCGR (0.64) GCGRKDM4EALDH1A1MAPTRAB9A
SCHEMBL2645711 0.90 GCGR (0.68) GCGRADCYAP1R1KDM4EALDH1A1MAPT
SCHEMBL2645708 0.90 GCGR (0.68) GCGRADCYAP1R1KDM4EALDH1A1MAPT
SCHEMBL2646533 0.88 GCGR (0.83) GCGRKDM4EALDH1A1MAPTRAB9A
SCHEMBL2646532 0.88 GCGR (0.83) GCGRKDM4EALDH1A1MAPTRAB9A
SCHEMBL7239653 0.86 GCGR (0.80) GCGRADCYAP1R1
SCHEMBL7239651 0.86 GCGR (0.80) GCGRADCYAP1R1

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
US-6613942-B1 Nonpeptide; 4-hydroxy benzoic acid hydrazides NOVO NORDISK A/S (DK) 2003-09-02 US claimed
US-6613942-B1 Nonpeptide; 4-hydroxy benzoic acid hydrazides NOVO NORDISK A/S (DK) 2003-09-02 US disclosed