SCHEMBL9761869

SCHEMBL9761869

CCCCCCCCCCCCOOCCN

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 9/20 0.52
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
ALDH1A1 P00352 1/20 0.52
TSHR P16473 1/20 0.52
EPHX1 P07099 1/20 0.52
CA1 P00915 7/20 0.43
CA2 P00918 7/20 0.43
CA9 Q16790 6/20 0.43
CA12 O43570 3/20 0.43
CA7 P43166 3/20 0.43
CA14 Q9ULX7 3/20 0.43
CA3 P07451 2/20 0.43
CA4 P22748 2/20 0.43
CA6 P23280 2/20 0.43
CA5A P35218 2/20 0.43
CA5B Q9Y2D0 2/20 0.43

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
SCHEMBL15109889 0.90 DNM1 (0.60) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL11119472 0.88 DNM1 (0.46) DNM1MEN1KMT2AALDH1A1TSHR
Hydrochloric Acid SCHEMBL11123209 0.86 DNM1 (0.48) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL3042426 0.86 MEN1 (0.48) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL10491770 0.86 THRB (0.57) MEN1KMT2ATSHRCA1CA2
SCHEMBL3826183 0.86 THRB (0.57) MEN1KMT2ATSHRCA1CA2
SCHEMBL1067348 0.86 THRB (0.57) MEN1KMT2ATSHRCA1CA2
SCHEMBL2119344 0.86 THRB (0.57) MEN1KMT2ATSHRCA1CA2
SCHEMBL21218973 0.86 THRB (0.57) MEN1KMT2ATSHRCA1CA2
SCHEMBL4162714 0.86 THRB (0.57) MEN1KMT2ATSHRCA1CA2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-3212435-A None JP disclosed
JP-H03212435-A POLYOLEFIN RESIN FILM MITSUBISHI KASEI CORP 1991-09-18 JP disclosed