SCHEMBL7255167

SCHEMBL7255167

CCCC(=O)N(Cc1nc2ccccc2n1C)c1ccc(-c2ccc(C(=O)O)o2)cc1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LTB4R2 Q9NPC1 7/20 0.44
HDAC6 Q9UBN7 1/20 0.43
TSHR P16473 1/20 0.42
ALDH1A1 P00352 3/20 0.42
HPGD P15428 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
KDM4E B2RXH2 1/20 0.42
NPC1 O15118 1/20 0.42
GLA P06280 1/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
PKM P14618 1/20 0.42
RAB9A P51151 1/20 0.42
PPARG P37231 2/20 0.40
USP2 O75604 1/20 0.39
AGTR1 P30556 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
SCHEMBL7258615 0.91 TSHR (0.43) LTB4R2HDAC6TSHRALDH1A1HPGD
SCHEMBL7259830 0.89 MAPKAPK2 (0.38) LTB4R2HDAC6TSHRALDH1A1HPGD
SCHEMBL7260764 0.87 ALDH1A1 (0.43) LTB4R2HDAC6TSHRALDH1A1HPGD
SCHEMBL7259765 0.83 LTB4R2 (0.39) LTB4R2TSHRALDH1A1HPGDSMN1; SMN2
SCHEMBL7259827 0.83 TSHR (0.44) TSHRALDH1A1HPGDKDM4ENPC1
SCHEMBL7255070 0.82 ALDH1A1 (0.40) HDAC6ALDH1A1HPGDSMN1; SMN2KDM4E
SCHEMBL7255149 0.76 NR1H4 (0.36) ALDH1A1HPGDSMN1; SMN2KDM4ENPC1
SCHEMBL7256248 0.76 LMNA (0.40) TSHRALDH1A1HPGDSMN1; SMN2KDM4E
SCHEMBL7259783 0.74 MAPKAPK2 (0.39) SMN1; SMN2
SCHEMBL7256246 0.70 LMNA (0.40) TSHRALDH1A1HPGDSMN1; SMN2KDM4E

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
WO-2003099812-A1 PHENYL-FURAN OR PHENYL-THIOPHENE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS MEDICINE PIERRE FABRE MEDICAMENT (FR) 2003-12-04 WO claimed
WO-2003099812-A1 PHENYL-FURAN OR PHENYL-THIOPHENE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS MEDICINE PIERRE FABRE MEDICAMENT (FR) 2003-12-04 WO disclosed