SCHEMBL6302545

SCHEMBL6302545

O=C(O)c1[c]ccc(I)c1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TPMT P51580 2/20 0.38
PTPRC P08575 1/20 0.34
PTPN2 P17706 1/20 0.34
PTPN1 P18031 1/20 0.34
PTPRA P18433 1/20 0.34
PTPRB P23467 1/20 0.34
PTPRE P23469 1/20 0.34
PTPN6 P29350 1/20 0.34
MAP2K2 P36507 1/20 0.32
MAP2K1 Q02750 1/20 0.32

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
SCHEMBL490251 0.76 KDM4E (0.42)
SCHEMBL5857066 0.76 KDM4E (0.42)
SCHEMBL4321490 0.74 KEAP1 (0.39)
SCHEMBL4023724 0.74 KDM4E (0.39)
SCHEMBL767180 0.74 TSHR (0.42) TPMT
SCHEMBL3735378 0.74 CSNK2A1 (0.41) TPMT
SCHEMBL3045441 0.74 KDM4E (0.41) PTPN1
SCHEMBL1630605 0.72 AKR1C3 (0.41)
SCHEMBL4025927 0.71 ACMSD (0.48)
SCHEMBL4626841 0.71 PARP1 (0.41)

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-6875764-B1 Urea and thiourea compounds useful for treatment of coccidiosis NEW PHARMA RESEARCH SWEDEN AB (SE) 2005-04-05 US disclosed