SCHEMBL456438

SCHEMBL456438

CCCCCCCCCCCCOc1cccc(OCCCCCCCCCCCC)c1OCCCCCCCCCCCC

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 3/20 0.56
LMNA P02545 2/20 0.56
TSHR P16473 2/20 0.56
CHRM1 P11229 1/20 0.56
ALOX15 P16050 1/20 0.56
ACHE P22303 1/20 0.56
KCNH2 Q12809 1/20 0.56
HIF1A Q16665 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.55
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
NR1I2 O75469 1/20 0.53
CYP3A4 P08684 1/20 0.53
ADRA2A P08913 1/20 0.53
MAPT P10636 1/20 0.53
OPRK1 P41145 1/20 0.53
HTR2B P41595 1/20 0.53
SLC6A3 Q01959 1/20 0.53
HDAC6 Q9UBN7 1/20 0.53
MCHR1 Q99705 3/20 0.53

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
SCHEMBL4527369 1.00 CHRM2 (0.56) CHRM2LMNATSHRCHRM1ALOX15
SCHEMBL30167843 1.00 CHRM2 (0.56) CHRM2LMNATSHRCHRM1ALOX15
SCHEMBL453505 1.00 CHRM2 (0.56) CHRM2LMNATSHRCHRM1ALOX15
SCHEMBL19612354 0.93 SMN1; SMN2 (0.69) CHRM2LMNATSHRCHRM1ALOX15
SCHEMBL1238407 0.91 LMNA (0.60) CHRM2LMNATSHRCHRM1ALOX15
SCHEMBL8974666 0.89 MCHR1 (0.48) CHRM2LMNATSHRCHRM1ALOX15
SCHEMBL11331788 0.89 MCHR1 (0.48) CHRM2LMNATSHRCHRM1ALOX15
SCHEMBL19612360 0.88 SMN1; SMN2 (0.52) CHRM2LMNATSHRCHRM1ALOX15
SCHEMBL1837216 0.87 LMNA (0.50) CHRM2LMNATSHRCHRM1ALOX15
SCHEMBL1836358 0.87 LMNA (0.50) CHRM2LMNATSHRCHRM1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022027769-A1 AZOBENZENE DERIVATIVE, PREPARATION METHOD THEREFOR, AZOPHENYL LIGHT-CONTROLLED REVERSIBLE ADHESIVE, AND METHOD FOR USING SAME 深圳市华星光电半导体显示技术有限公司 2022-02-10 WO claimed
WO-2022269235-A1 CYCLOPROPENIUM COMPOUNDS UNIVERSITY OF DURHAM (GB) 2022-12-29 WO disclosed
CN-107286193-B (3,4,5- tri- (dodecyloxy) benzyl) triphenyl Si Fu Peng Suan Phosphonium and its application in electrogenerated chemiluminescence 南京理工大学 2019-06-25 CN disclosed
CN-107286193-A (3,4,5 3 (dodecyloxy) benzyl) triphenyl Si Fu Peng Suan Phosphonium and its application in electrogenerated chemiluminescence 南京理工大学 2017-10-24 CN disclosed
US-9623046-B2 Amphiphilic Janus-dendrimers THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2017-04-18 US disclosed
CN-106279049-A One class temperature induced color changing triazole ferrum (II) coordination compound and its preparation method and application 陕西师范大学 2017-01-04 CN disclosed
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-20120308640-A1 AMPHIPHILIC JANUS-DENDRIMERS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2012-12-06 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
WO-2011017500-A1 AMPHIPHILIC JANUS-DENDRIMERS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2011-02-10 WO 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-20120308640-A1 AMPHIPHILIC JANUS-DENDRIMERS OR10J3, H1-10, CXCR3 CHRM2 95/4885LMNA 2697/4885TSHR 852/4885

“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.