SCHEMBL1201162

SCHEMBL1201162

CCCCCCCCCCCOc1cc(CO)cc(OCCCCCCCCCCC)c1OCCCCCCCCCCC

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
THRA P10827 3/20 0.45
THRB P10828 3/20 0.45
NR5A1 Q13285 1/20 0.41
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

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
SCHEMBL31111385 1.00 THRA (0.45) THRATHRBNR5A1MEN1NR1I2
SCHEMBL1201515 1.00 THRA (0.45) THRATHRBNR5A1MEN1NR1I2
SCHEMBL1201502 1.00 THRA (0.45) THRATHRBNR5A1MEN1NR1I2
SCHEMBL1201128 1.00 THRA (0.45) THRATHRBNR5A1MEN1NR1I2
SCHEMBL1201460 1.00 THRA (0.45) THRATHRBNR5A1MEN1NR1I2
SCHEMBL4864512 1.00 THRA (0.45) THRATHRBNR5A1MEN1NR1I2
SCHEMBL96240 1.00 THRA (0.45) THRATHRBNR5A1MEN1NR1I2
SCHEMBL1201657 1.00 THRA (0.45) THRATHRBNR5A1MEN1NR1I2
SCHEMBL1200630 1.00 THRA (0.45) THRATHRBNR5A1MEN1NR1I2
SCHEMBL29341218 1.00 THRA (0.45) THRATHRBNR5A1MEN1NR1I2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2253634-A9 LIQUID PORPHYRIN DERIVATIVE AND METHOD FOR PRODUCING THE SAME Dai Nippon Printing Co., Ltd. (JP) 2011-06-01 EP disclosed
US-20110046366-A1 LIQUID PORPHYRIN DERIVATIVE, AND METHOD FOR PRODUCING THE SAME DAI NIPPON PRINTING CO., LTD. (JP) 2011-02-24 US disclosed
EP-2253634-A1 LIQUID PORPHYRIN DERIVATIVE AND METHOD FOR PRODUCING THE SAME Dai Nippon Printing Co., Ltd. (JP) 2010-11-24 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-20110046366-A1 LIQUID PORPHYRIN DERIVATIVE, AND METHOD FOR PRODUCING THE SAME PPOX, OR10J3, ORC3 THRA 2295/4885THRB 2750/4885NR5A1 2018/4885

“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.