SCHEMBL10033147

SCHEMBL10033147

CCc1cncnc1Cc1ccc(I(C)C)cc1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 1/20 0.33
DHFR P00374 1/20 0.32
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL9009276 0.81 CYP11B2 (0.45) CYP11B2
SCHEMBL10033030 0.78 PDE10A (0.35) DHFRRAB9ASMN1; SMN2
SCHEMBL2605772 0.72 CYP17A1 (0.36) CYP11B2
SCHEMBL10033146 0.71 SMN1; SMN2 (0.35) NPC1RAB9ASMN1; SMN2
SCHEMBL25596550 0.70 ALDH1A1 (0.34) CYP11B2DHFRNPC1RAB9ASMN1; SMN2
SCHEMBL25596755 0.69 PLA2G7 (0.39) CYP11B2
SCHEMBL10033200 0.68 L3MBTL1 (0.34) CYP11B2SMN1; SMN2
SCHEMBL25596754 0.68 CYP11B2 (0.40) CYP11B2
SCHEMBL14290733 0.68 ATM (0.33)
SCHEMBL10034492 0.66 CYP11B1 (0.38) CYP11B2

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
WO-2012008527-A1 PYRIMIDINE COMPOUND AND PEST-CONTROL USAGE THEREFOR 住友化学株式会社 (JP) 2012-01-19 WO disclosed