SCHEMBL17162145

SCHEMBL17162145

CCCCCCCCOc1ccc2ccc(OCCCCCCCC)cc2c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR5A1 Q13285 1/20 0.58
TSHR P16473 2/20 0.56
THRA P10827 1/20 0.55
LTA4H P09960 2/20 0.52
TP53 P04637 1/20 0.51
CA12 O43570 1/20 0.51
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
CA3 P07451 1/20 0.51
CA4 P22748 1/20 0.51
CA6 P23280 1/20 0.51
CA7 P43166 1/20 0.51
CA9 Q16790 1/20 0.51
CA14 Q9ULX7 1/20 0.51
CA5B Q9Y2D0 1/20 0.51
KDM4E B2RXH2 1/20 0.50
MAPK1 P28482 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
PLA2G4B P0C869 1/20 0.50
NPC1 O15118 1/20 0.50

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
SCHEMBL17018215 1.00 NR5A1 (0.58) NR5A1TSHRTHRALTA4HTP53
SCHEMBL30426140 0.96 NR5A1 (0.58) NR5A1TSHRTHRALTA4HTP53
SCHEMBL4945033 0.96 NR5A1 (0.62) NR5A1TSHRTHRALTA4HTP53
SCHEMBL10642885 0.96 NR5A1 (0.62) NR5A1TSHRTHRALTA4HTP53
SCHEMBL347683 0.96 NR5A1 (0.62) NR5A1TSHRTHRALTA4HTP53
SCHEMBL15772990 0.94 CA12 (0.56) NR5A1THRALTA4HCA12CA1
SCHEMBL8746015 0.92 KDM4E (0.61) NR5A1TSHRLTA4HKDM4EMAPK1
SCHEMBL11077065 0.92 KDM4E (0.61) NR5A1TSHRLTA4HKDM4EMAPK1
SCHEMBL5374714 0.92 KDM4E (0.61) NR5A1TSHRLTA4HKDM4EMAPK1
SCHEMBL22753136 0.92 KDM4E (0.61) NR5A1TSHRLTA4HKDM4EMAPK1

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
US-9465288-B2 Sulfonium salt compound, method for producing the same, and photoacid generator DSP GOKYO FOOD & CHEMICAL CO., LTD. (JP) 2016-10-11 US disclosed
US-20150293445-A1 NOVEL SULFONIUM SALT COMPOUND, METHOD FOR PRODUCING THE SAME, AND PHOTOACID GENERATOR MP GOKYO FOOD & CHEMICAL CO., LTD. (JP) 2015-10-15 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150293445-A1 NOVEL SULFONIUM SALT COMPOUND, METHOD FOR PRODUCING THE SAME, AND PHOTOACID GENERATOR FGFR1, ARSA, PAOX NR5A1 639/4885TSHR 154/4885THRA 1837/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.