SCHEMBL5229092

SCHEMBL5229092

Cc1c(C(=O)O)sc2c1c(C1CCCCC1)c(-c1ccccc1)n2Cc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ADORA2B P29275 2/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
HTT P42858 1/20 0.40
TP53 P04637 3/20 0.38
LMNA P02545 1/20 0.37
POLB P06746 1/20 0.37
NOTUM Q6P988 1/20 0.36
MAPT P10636 1/20 0.36

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
SCHEMBL5234784 0.80 ADORA2B (0.46) ADORA2BMEN1KMT2AHTTTP53
SCHEMBL2996554 0.77 ALDH1A1 (0.39) MEN1KMT2AHTTLMNA
SCHEMBL2996795 0.73 KDM4E (0.45) KMT2APOLBMAPT
SCHEMBL2998608 0.73 CNR1 (0.37) MEN1KMT2AHTTLMNAPOLB
SCHEMBL8506145 0.71 ADORA2B (0.50) ADORA2BMEN1KMT2ATP53LMNA
SCHEMBL5440965 0.69 FABP4 (0.46)
SCHEMBL5432018 0.69 FABP4 (0.54) TP53LMNA
SCHEMBL5234397 0.69 CNR1 (0.36) MEN1KMT2ALMNAPOLBMAPT
SCHEMBL5435711 0.68 FABP4 (0.49) TP53
SCHEMBL13211511 0.67 ALDH1A1 (0.37) MEN1KMT2ALMNAPOLB

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
EP-1664059-B1 THIENOPYRROLES AS ANTIVIRAL AGENTS ANGELETTI P IST RICHERCHE BIO (IT) 2007-09-12 EP claimed