SCHEMBL20354536

SCHEMBL20354536

COc1cc(N(C)C)cc(OC)c1Cc1c(OC)cc(N(C)C)cc1OC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CALM1 P0DP23 2/20 0.40
CYP3A4 P08684 2/20 0.40
TSHR P16473 2/20 0.40
MEN1 O00255 1/20 0.40
LMNA P02545 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C19 P33261 1/20 0.40
KMT2A Q03164 1/20 0.40
NQO2 P16083 1/20 0.39
CRHR1 P34998 1/20 0.39
TUBB4A P04350 1/20 0.38
TUBB P07437 1/20 0.38
TUBA3C P0DPH7 1/20 0.38
TUBA1B P68363 1/20 0.38
TUBA4A P68366 1/20 0.38
TUBB4B P68371 1/20 0.38
TUBB3 Q13509 1/20 0.38
TUBB2A Q13885 1/20 0.38
TUBB8 Q3ZCM7 1/20 0.38
TUBA3E Q6PEY2 1/20 0.38

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
SCHEMBL20354546 0.81 PDGFRB (0.48) CALM1CYP3A4TSHRMEN1LMNA
SCHEMBL21614179 0.81 PTPN1 (0.38) TSHRALDH1A1TDP1
SCHEMBL2096172 0.78 ALDH1A1 (0.50) CALM1CYP3A4CYP1A2CA2ALDH1A1
SCHEMBL21614175 0.78 HTR2A (0.38) CALM1CYP3A4TSHRMEN1LMNA
SCHEMBL21553367 0.77 ADK (0.43) CALM1CYP3A4TSHRMEN1LMNA
SCHEMBL21553366 0.77 TUBB1 (0.71) TSHRMEN1KMT2ANQO2TUBB4A
SCHEMBL14609613 0.76 TUBB4A (0.58) CYP3A4LMNACYP1A2TUBB4ATUBB
SCHEMBL12671987 0.76 NQO2 (0.41) CALM1CYP3A4TSHRMEN1LMNA
SCHEMBL20339017 0.75 CA12 (0.38) CALM1CYP3A4TSHRMEN1LMNA
SCHEMBL28979980 0.74 NQO2 (0.40) CALM1CYP3A4TSHRMEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3562817-B1 ORGANIC MATERIALS WITH SPECIAL OPTICAL EFFECTS CENTRE NAT RECH SCIENT (FR) 2023-11-15 EP disclosed
EP-3562817-B1 ORGANIC MATERIALS WITH SPECIAL OPTICAL EFFECTS CENTRE NAT RECH SCIENT (FR) 2023-11-15 EP disclosed
US-11613513-B2 Organic materials with special optical effects CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2023-03-28 US disclosed
US-20190337885-A1 Organic Materials with Special Optical Effects CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2019-11-07 US disclosed
US-20190337885-A1 Organic Materials with Special Optical Effects CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2019-11-07 US disclosed
WO-2018122359-A1 ORGANIC MATERIALS WITH SPECIAL OPTICAL EFFECTS CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2018-07-05 WO disclosed
US-20160193329-A1 Deletion Mutants of Flagellin and Methods of Use VAXINNATE CORPORATION 2016-07-07 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 (3 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-20190337885-A1 Organic Materials with Special Optical Effects IK, TYR, MITF CALM1 1657/4885CYP3A4 801/4885TSHR 4390/4885
US-11613513-B2 Organic materials with special optical effects IK, TYR, MITF CALM1 1657/4885CYP3A4 801/4885TSHR 4390/4885
US-20160193329-A1 Deletion Mutants of Flagellin and Methods of Use MYD88, IFNG, NOD2 CALM1 1131/4885CYP3A4 4871/4885TSHR 3399/4885

“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.