SCHEMBL6307235

SCHEMBL6307235

Cc1nnc(Sc2nc3ccc(-c4ccccc4C=O)cc3nc2-c2ccc(F)c(F)c2F)s1

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PIK3R1 P27986 1/20 0.33
PIK3CA P42336 1/20 0.33
TGFBR1 P36897 1/20 0.31
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2C9 P11712 1/20 0.30
HPGD P15428 1/20 0.30
CYP2C19 P33261 1/20 0.30
HTT P42858 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
POLB P06746 1/20 0.30

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
SCHEMBL6306346 0.81 GLP1R (0.40) PIK3R1PIK3CAALDH1A1LMNAHPGD
SCHEMBL2599803 0.65 CTSL (0.53) ALDH1A1LMNAHPGDHTTSMN1; SMN2
SCHEMBL6310836 0.61 ALDH1A1 (0.44) ALDH1A1LMNACYP1A2CYP2C19SMN1; SMN2
SCHEMBL6304431 0.61 ALDH1A1 (0.44) ALDH1A1LMNACYP1A2CYP2C19SMN1; SMN2
SCHEMBL2476180 0.60 TNKS (0.46) ALDH1A1LMNA
SCHEMBL2599643 0.60 ALDH1A1 (0.41) ALDH1A1LMNACYP1A2CYP2C9HPGD
SCHEMBL1954351 0.59 ALDH1A1 (0.42) ALDH1A1LMNACYP1A2HPGDSMN1; SMN2
SCHEMBL2474403 0.58 PDE3B (0.45) LMNACYP1A2CYP2C9HPGDCYP2C19
SCHEMBL3941247 0.58 XDH (0.41) LMNA
SCHEMBL1631167 0.58 PTGS2 (0.54) LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6927214-B1 Non-peptide GLP-1 agonists NOVO NORDISK A/S (DK) 2005-08-09 US disclosed