SCHEMBL8189491

SCHEMBL8189491

O=S(=O)(Cc1ccccc1)OC1CCCCO1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.42
ALDH1A1 P00352 2/20 0.41
HPGD P15428 2/20 0.41
USP2 O75604 1/20 0.41
HSD17B10 Q99714 1/20 0.41
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
TSHR P16473 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MEN1 O00255 1/20 0.38
KDM4C Q9H3R0 1/20 0.37
LMNA P02545 1/20 0.36
MAPK1 P28482 1/20 0.36
FKBP1A P62942 1/20 0.36

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
SCHEMBL13045589 0.79 ALDH1A1 (0.44) KMT2AALDH1A1HPGDUSP2HSD17B10
SCHEMBL8338883 0.78 KMT2A (0.50) KMT2AALDH1A1HPGDUSP2HSD17B10
SCHEMBL8790740 0.77 ALDH1A1 (0.48) ALDH1A1TSHRSMN1; SMN2
SCHEMBL4932875 0.76 HPGD (0.50) KMT2AALDH1A1HPGDUSP2HSD17B10
SCHEMBL28712597 0.74 MEN1 (0.33) KMT2AMEN1
SCHEMBL16598014 0.74 KMT2A (0.46) KMT2AALDH1A1HPGDUSP2HSD17B10
SCHEMBL4184332 0.73 KDM4C (0.47) KMT2AMEN1KDM4C
SCHEMBL11258174 0.72 KDM4C (0.46) KMT2AALDH1A1MEN1KDM4C
SCHEMBL9067290 0.72 HPGD (0.46) KMT2AALDH1A1HPGDUSP2HSD17B10
SCHEMBL5697307 0.71 MEN1 (0.50) KMT2ACA12CA1CA2CA9

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-6090522-A Chemical amplification photoresist comprising a reverse reaction inhibitor NEC CORPORATION (JP) 2000-07-18 US disclosed