SCHEMBL7247406

SCHEMBL7247406

OCc1cnc(S)n1Cc1cccc(Br)c1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ XDH P47989 1/20 0.46
▸ POLB P06746 2/20 0.45
▸ HTT P42858 2/20 0.44
▸ MAPK1 P28482 3/20 0.43
▸ CYP11B1 P15538 1/20 0.41
▸ ADRA2C P18825 1/20 0.41
▸ CYP11B2 P19099 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ TP53 P04637 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ KMT2A Q03164 2/20 0.38
▸ ERCC5 P28715 1/20 0.38
▸ FEN1 P39748 1/20 0.38
▸ F2RL3 Q96RI0 1/20 0.38
▸ MEN1 O00255 1/20 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
SCHEMBL8171565 0.82 POLB (0.46) POLBHTTMAPK1CYP11B1CYP11B2
SCHEMBL7165398 0.82 POLB (0.63) POLBHTTMAPK1TP53KMT2A
SCHEMBL8126668 0.74 MAPK1 (0.54) POLBHTTMAPK1CYP11B1CYP11B2
SCHEMBL7252343 0.73 MAPK1 (0.40) POLBHTTMAPK1TP53KMT2A
SCHEMBL7250957 0.72 CYP11B1 (0.52) XDHCYP11B1ADRA2CCYP11B2SMN1; SMN2
SCHEMBL7252340 0.71 KDM4E (0.49) POLBMAPK1ADRA2CSMN1; SMN2MAPT
SCHEMBL10639259 0.70 POLB (0.49) POLBHTTMAPK1TDP1KMT2A
SCHEMBL7195630 0.70 CYP11B1 (0.56) POLBHTTMAPK1CYP11B1CYP11B2
SCHEMBL10546416 0.69 CCR2 (0.40) POLBHTTMAPK1CYP11B1CYP11B2
SCHEMBL93041 0.68 — —

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-6630593-B1 A process for preparing a 1-substituted 5-hydroxymethylimidazole of the formula: wherein R represents alkyl, hydroxyalkyl, allyl, or substituted or unsubstituted arylmethyl or diarylmethyl, comprising the step of reacting a LG CHEM INVESTMENT LTD. (KR) 2003-10-07 — — US disclosed
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