SCHEMBL2726437

SCHEMBL2726437

COc1cc(F)c(-c2c3cccc(F)c3c(-c3c(F)c(F)c(OC)c(F)c3F)c3c(F)ccc(F)c23)c(F)c1

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CDK2 P24941 1/20 0.32
MIF P14174 1/20 0.32
KRAS P01116 1/20 0.30
TUBB4A P04350 2/20 0.30
TUBB P07437 2/20 0.30
TUBA3C P0DPH7 2/20 0.30
TUBA1B P68363 2/20 0.30
TUBA4A P68366 2/20 0.30
TUBB4B P68371 2/20 0.30
TUBB3 Q13509 2/20 0.30
TUBB2A Q13885 2/20 0.30
TUBB8 Q3ZCM7 2/20 0.30
TUBA3E Q6PEY2 2/20 0.30
TUBA1A Q71U36 2/20 0.30
TUBA1C Q9BQE3 2/20 0.30
TUBB6 Q9BUF5 2/20 0.30
TUBB2B Q9BVA1 2/20 0.30
TUBB1 Q9H4B7 2/20 0.30

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
SCHEMBL2939722 0.94 TSHR (0.32) TSHRALDH1A1MIF
SCHEMBL2726247 0.93 ALDH1A1 (0.34) TSHRALDH1A1CDK2MIFNFE2L2
SCHEMBL2710065 0.92 NFE2L2 (0.33) TSHRALDH1A1MIFTUBB4ATUBB
SCHEMBL2942677 0.91 TSHR (0.32) TSHRALDH1A1MIF
SCHEMBL2724837 0.91 KDM4E (0.35) TSHRALDH1A1CDK2BUB1
SCHEMBL2725402 0.90 ALDH1A1 (0.35) ALDH1A1KRASTUBB4ATUBBTUBA3C
SCHEMBL2727335 0.90 ALDH1A1 (0.37) ALDH1A1CDK2MIFNFE2L2
SCHEMBL2726766 0.89 ALDH1A1 (0.33) ALDH1A1CDK2MIFNFE2L2
SCHEMBL12086082 0.89 KDM4E (0.34) ALDH1A1KRASTUBB4ATUBBTUBA3C
SCHEMBL2728240 0.89 KDM4E (0.34) ALDH1A1KRASTUBB4ATUBBTUBA3C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2445987-B1 BLUE/VIOLET DIPHENYLANTHRACENE CHEMILUMINESCENT FLUORESCERS CYALUME TECH INC (US) 2018-05-02 EP disclosed
EP-2445987-B1 BLUE/VIOLET DIPHENYLANTHRACENE CHEMILUMINESCENT FLUORESCERS CYALUME TECH INC (US) 2018-05-02 EP disclosed
US-8257620-B2 Blue/violet diphenylanthracene chemiluminescent fluorescers CYALUME TECHNOLOGIES, INC. (US) 2012-09-04 US disclosed
US-8257620-B2 Blue/violet diphenylanthracene chemiluminescent fluorescers CYALUME TECHNOLOGIES, INC. (US) 2012-09-04 US disclosed
EP-2445987-A1 BLUE/VIOLET DIPHENYLANTHRACENE CHEMILUMINESCENT FLUORESCERS Cyalume Technologies, Inc (US) 2012-05-02 EP disclosed
US-20100327240-A1 Blue/violet diphenylanthracene chemiluminescent fluorescers CYALUME TECHNOLOGIES, INC. 2010-12-30 US disclosed
US-20100327240-A1 Blue/violet diphenylanthracene chemiluminescent fluorescers CYALUME TECHNOLOGIES, INC. 2010-12-30 US disclosed
WO-2010151654-A1 BLUE/VIOLET DIPHENYLANTHRACENE CHEMILUMINESCENT FLUORESCERS CYALUME TECHNOLOGIES, INC. (US) 2010-12-29 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-20100327240-A1 Blue/violet diphenylanthracene chemiluminescent fluorescers CYP2F1, FLAD1, AFF1 TSHR 1174/4885ALDH1A1 34/4885CDK2 1367/4885

“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.