SCHEMBL6607539

SCHEMBL6607539

CCc1oc(-c2ccccc2F)nc1CCCO

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
ALDH1A1 P00352 4/20 0.40
KDM4E B2RXH2 4/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
MAPT P10636 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
POLB P06746 2/20 0.39
TSHR P16473 2/20 0.39
GAA P10253 1/20 0.39
THRB P10828 1/20 0.39
CXCR4 P61073 1/20 0.38
C1R P00736 1/20 0.38
TP53 P04637 1/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
F7 P08709 2/20 0.37

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
SCHEMBL6604633 0.81 PPARG (0.47) ALDH1A1KDM4ETSHRHPGDNPC1
SCHEMBL6607542 0.78 PPARG (0.46) MEN1KMT2AALDH1A1SMN1; SMN2MAPT
SCHEMBL5015708 0.75 POLB (0.52) MEN1KMT2AALDH1A1SMN1; SMN2MAPT
SCHEMBL6603331 0.72 PPARA (0.47) ALDH1A1KDM4EMAPTTSHRHPGD
SCHEMBL6608776 0.70 PPARG (0.42) MEN1KMT2AALDH1A1SMN1; SMN2MAPT
SCHEMBL13770662 0.69 C1R (0.45) ALDH1A1SMN1; SMN2MAPTCYP1A2CYP3A4
SCHEMBL4485984 0.68 SMN1; SMN2 (0.46) MEN1KMT2AALDH1A1SMN1; SMN2MAPT
SCHEMBL4363143 0.66 POLB (0.51) MEN1KMT2AALDH1A1SMN1; SMN2MAPT
SCHEMBL5559278 0.65
SCHEMBL6606425 0.65 KDM4E (0.49) KMT2AALDH1A1KDM4ETSHRHPGD

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-1102757-B1 SUBSTITUTED OXAZOLE AND THIAZOLE DERIVATIVES AS HPPAR GAMMA AND HPPAR ALPHA ACTIVATORS GLAXO GROUP LTD (GB) 2004-04-14 EP disclosed