SCHEMBL3165489

SCHEMBL3165489

CCCCCCCCOc1ccc(OCCCCCCCC)c2c1sc1c(OCCCCCCCC)ccc(OCCCCCCCC)c12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR5A1 Q13285 1/20 0.42
MEN1 O00255 1/20 0.41
NR1I2 O75469 1/20 0.41
LMNA P02545 1/20 0.41
CHRM2 P08172 1/20 0.41
CYP3A4 P08684 1/20 0.41
ADRA2A P08913 1/20 0.41
MAPT P10636 1/20 0.41
OPRK1 P41145 1/20 0.41
HTR2B P41595 1/20 0.41
SLC6A3 Q01959 1/20 0.41
KMT2A Q03164 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
CHUK O15111 1/20 0.41
DAPK3 O43293 1/20 0.41
JAK2 O60674 1/20 0.41
ROCK2 O75116 1/20 0.41
PRKCG P05129 1/20 0.41
CDK1 P06493 1/20 0.41
PIM1 P11309 1/20 0.41

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
SCHEMBL3167301 0.89 MEN1 (0.35) NR5A1MEN1NR1I2LMNACHRM2
SCHEMBL14523533 0.87 THRB (0.36) NR5A1MEN1NR1I2LMNACHRM2
SCHEMBL346865 0.79 MCHR1 (0.47) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL3164944 0.77 THRA (0.38) NR5A1MEN1NR1I2LMNACHRM2
SCHEMBL17207305 0.76 THRA (0.39) NR5A1MEN1NR1I2LMNACHRM2
SCHEMBL17189731 0.76 THRA (0.39) NR5A1MEN1NR1I2LMNACHRM2
SCHEMBL17189726 0.76 THRA (0.39) NR5A1MEN1NR1I2LMNACHRM2
SCHEMBL348189 0.76 NR5A1 (0.50) NR5A1MEN1NR1I2LMNACHRM2
SCHEMBL348188 0.76 NR5A1 (0.50) NR5A1MEN1NR1I2LMNACHRM2
SCHEMBL3165980 0.75 MCHR1 (0.47) NR5A1MEN1NR1I2LMNACHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1334956-B1 Method for preparing sulfone or sulfoxide compound SUMITOMO CHEMICAL CO (JP) 2010-03-17 EP disclosed
US-6916938-B2 Method for preparing sulfone or sulfoxide compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-07-12 US disclosed
US-20030171589-A1 Method for preparing sulfone or sulfoxide compound SUMITOMO CHEMICAL COMPANY, LIMITED 2003-09-11 US disclosed
EP-1334956-A2 Method for preparing sulfone or sulfoxide compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-08-13 EP 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-20030171589-A1 Method for preparing sulfone or sulfoxide compound TST, SDHB, GPX4 NR5A1 3834/4885MEN1 2971/4885NR1I2 2542/4885

“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.