Sugi Predict

Sugi Predict / Compounds / SCHEMBL452254

SCHEMBL452254

SCHEMBL452254

CCCCCCOc1cc(COc2cc(CO)cc(OCc3cc(OCCCCCC)c(OCCCCCC)c(OCCCCCC)c3)c2OCc2cc(OCCCCCC)c(OCCCCCC)c(OCCCCCC)c2)cc(OCCCCCC)c1OCCCCCC

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ THRA P10827 3/20 0.40
▸ THRB P10828 3/20 0.40
▸ NR5A1 Q13285 1/20 0.39
▸ SRC P12931 1/20 0.39

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
SCHEMBL13837298 1.00 THRA (0.40) THRATHRBNR5A1SRC
SCHEMBL444543 0.93 S1PR2 (0.44) THRATHRBNR5A1SRC
SCHEMBL13963208 0.93 S1PR2 (0.44) THRATHRBNR5A1SRC
SCHEMBL1201657 0.92 THRA (0.45) THRATHRBNR5A1
SCHEMBL1200630 0.92 THRA (0.45) THRATHRBNR5A1
SCHEMBL96240 0.92 THRA (0.45) THRATHRBNR5A1
SCHEMBL4864512 0.92 THRA (0.45) THRATHRBNR5A1
SCHEMBL1201128 0.92 THRA (0.45) THRATHRBNR5A1
SCHEMBL1201460 0.92 THRA (0.45) THRATHRBNR5A1
SCHEMBL1201162 0.92 THRA (0.45) THRATHRBNR5A1

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-8968591-B2 Organic piezoelectric material, ultrasound transducer, ultrasound probe, and ultrasound medical diagnostic imaging system KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2015-03-03 — — US disclosed
US-20120065516-A1 ORGANIC PIEZOELECTRIC MATERIAL, ULTRASOUND TRANSDUCER, ULTRASOUND PROBE, AND ULTRASOUND MEDICAL DIAGNOSTIC IMAGING SYSTEM KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2012-03-15 — — US disclosed