SCHEMBL16348397

SCHEMBL16348397

CC(C)(C)[Si](C)(C)Oc1ccc(Cl)cc1-c1cc[nH]n1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ USP2 O75604 1/20 0.36
▸ PRNP P04156 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ PPARG P37231 1/20 0.36
▸ MAPK10 P53779 1/20 0.36
▸ NCOA2 Q15596 1/20 0.36
▸ NCOA1 Q15788 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ RXFP1 Q9HBX9 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ AGPAT2 O15120 9/20 0.34
▸ IDO1 P14902 3/20 0.33
▸ GAA P10253 1/20 0.32
▸ NPC1 O15118 1/20 0.30
▸ TSHR P16473 1/20 0.30
▸ STAT3 P40763 1/20 0.30
▸ RAB9A P51151 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
SCHEMBL13523180 0.84 HPGD (0.31) HPGD
SCHEMBL28120093 0.75 JAK2 (0.39) KDM4EALDH1A1HPGDTSHRSMN1; SMN2
SCHEMBL2989844 0.74 S1PR4 (0.42) HPGDTDP1NPC1STAT3RAB9A
SCHEMBL15746726 0.73 PDE4A (0.32) HPGDTSHRSMN1; SMN2
SCHEMBL31039366 0.72 IDO1 (0.38) KDM4EALDH1A1USP2PRNPHPGD
SCHEMBL15079440 0.72 IDO1 (0.58) AGPAT2IDO1F7F3DYRK1A
SCHEMBL12378188 0.72 CYP1A2 (0.43) KDM4EALDH1A1NPSR1NPC1TSHR
SCHEMBL21056991 0.72 TSHR (0.57) KDM4EALDH1A1HPGDGAATSHR
SCHEMBL21056993 0.72 TSHR (0.57) KDM4EALDH1A1HPGDGAATSHR
SCHEMBL11624239 0.72 IDO1 (0.56) ALDH1A1HPGDRXFP1AGPAT2IDO1

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-7642358-B2 Substituted phenylacetic acids METABOLEX, INC. (US) 2010-01-05 — — US disclosed
Send feedback