SCHEMBL20370899

SCHEMBL20370899

O=C(O)c1cc(OCCOCCCO)c(OCCOCCCO)c(OCCOCCCO)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 6/20 0.45
ALDH1A1 P00352 1/20 0.41
KMT2A Q03164 1/20 0.41
PTK2B Q14289 1/20 0.41
PLAU P00749 1/20 0.40
RARG P13631 4/20 0.39
POLB P06746 2/20 0.37
CASP6 P55212 1/20 0.37
PARP1 P09874 1/20 0.36
PLA2G2A P14555 1/20 0.36
RARA P10276 3/20 0.36
ALOX15 P16050 1/20 0.36
HTT P42858 1/20 0.36
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA3 P07451 1/20 0.35
PKM P14618 1/20 0.35
CA4 P22748 1/20 0.35
CA6 P23280 1/20 0.35

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
SCHEMBL31578768 0.90 ALDH1A1 (0.44) RARBALDH1A1KMT2APTK2BPLAU
SCHEMBL8659522 0.85 PLA2G2A (0.46) RARBALDH1A1PLAURARGPOLB
SCHEMBL8913807 0.83 PLAU (0.46) RARBKMT2APLAURARGPOLB
SCHEMBL8207625 0.83 TNFRSF1A (0.47) RARBALDH1A1KMT2APTK2BPLAU
SCHEMBL26545271 0.83 TNFRSF1A (0.47) RARBALDH1A1KMT2APTK2BPLAU
SCHEMBL19970626 0.83 TSHR (0.54) RARBALDH1A1KMT2ARARGPOLB
SCHEMBL13498580 0.83 TNFRSF1A (0.47) RARBALDH1A1KMT2APTK2BPLAU
SCHEMBL16072742 0.83 RARB (0.46) RARBALDH1A1KMT2APTK2BPLAU
SCHEMBL19970624 0.81 TPMT (0.56) ALDH1A1KMT2APOLBHTTCA12
SCHEMBL16232209 0.80 RARB (0.38) RARBALDH1A1KMT2APTK2BPLAU

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-20180197688-A1 PHOTOELECTRIC CONVERSION ELEMENT AND SOLAR CELL RICOH COMPANY, LTD. (JP) 2018-07-12 US disclosed