SCHEMBL8519956

SCHEMBL8519956

CCCCCCCCCCCCCCCCCCn1ccc(C(=O)O)c1C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 2/20 0.54
CDC25A P30304 1/20 0.42
CYP1A2 P05177 3/20 0.41
CYP2C19 P33261 3/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
GAA P10253 1/20 0.41
CYP2C9 P11712 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
KAT8 Q9H7Z6 2/20 0.41
PPARA Q07869 1/20 0.41
EEF2K O00418 2/20 0.40
EEF2 P13639 2/20 0.40
ALDH1A1 P00352 1/20 0.40
PLK4 O00444 1/20 0.40
JAK2 O60674 1/20 0.40
EGFR P00533 1/20 0.40
TYK2 P29597 1/20 0.40
FLT3 P36888 1/20 0.40
BLM P54132 1/20 0.40

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
SCHEMBL22748747 0.83 RARB (0.43) NOTUMCDC25ACYP1A2CYP2C19MEN1
SCHEMBL3493577 0.79 NOTUM (0.64) NOTUMMEN1KMT2ATDP1ALDH1A1
SCHEMBL2804808 0.77 NOTUM (0.41) NOTUMMEN1KMT2AKAT8PPARA
SCHEMBL27562479 0.76 TSHR (0.47) MEN1KMT2AGAATDP1ALDH1A1
SCHEMBL9807558 0.75 CDC25A (0.40) CDC25AMEN1KMT2AEEF2KEEF2
SCHEMBL11638318 0.75 CNR2 (0.52) CDC25ACYP1A2CYP2C19MEN1KMT2A
Bromide SCHEMBL29212810 0.75 NPC1 (0.43) CDC25ACYP1A2CYP2C19MEN1KMT2A
SCHEMBL5179451 0.74 APP (0.56) CYP2C19CYP2C9ALDH1A1
SCHEMBL30982414 0.74 APP (0.56) CYP2C19CYP2C9ALDH1A1
SCHEMBL30982984 0.74 APP (0.56) CYP2C19CYP2C9ALDH1A1

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-0550349-B1 Electroconductible polymer compositions containing amphiphilic polymerisable pyrrole derivatives, their preparation and use TORAY PLASTICS EUROP SA (FR) 1999-09-29 EP disclosed
EP-0550349-A1 Electroconductible polymer compositions containing amphiphilic polymerisable pyrrole derivatives, their preparation and use RHONE-POULENC FILMS (FR) 1993-07-07 EP disclosed