SCHEMBL3875883

SCHEMBL3875883

[c]1c2ccccc2c(-c2cc(-c3ccccc3)cc(-c3ccccc3)c2)c2ccccc12

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38
ACHE P22303 4/20 0.35
ESR1 P03372 3/20 0.35
ESR2 Q92731 3/20 0.35
CRHBP P24387 1/20 0.33
CRHR2 Q13324 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
EGFR P00533 1/20 0.32
HPRT1 P00492 1/20 0.32
GP6 Q9HCN6 1/20 0.32
HSP90AA1 P07900 1/20 0.32
KMO O15229 1/20 0.31
TAAR1 Q96RJ0 1/20 0.31
MAOA P21397 1/20 0.31
NPC1 O15118 1/20 0.31
NTSR1 P30989 1/20 0.31
RAB9A P51151 1/20 0.31
ALOX5 P09917 1/20 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
SCHEMBL22635772 0.90 MAOA (0.39) ALDH1A1ACHEESR1ESR2MEN1
SCHEMBL15453046 0.87 ACHE (0.42) ALDH1A1ACHEESR1ESR2EGFR
SCHEMBL1820644 0.87 ACHE (0.45) ALDH1A1ACHEESR1ESR2EGFR
SCHEMBL28762429 0.82 ESR1 (0.39) ALDH1A1ACHEESR1ESR2MEN1
SCHEMBL29373135 0.82 ALDH1A1 (0.50) ALDH1A1ACHEESR1ESR2CRHBP
SCHEMBL261400 0.82 ALDH1A1 (0.50) ALDH1A1ACHEESR1ESR2CRHBP
SCHEMBL23702367 0.80 ALDH1A1 (0.47) ALDH1A1ACHEESR1ESR2CRHBP
SCHEMBL2965154 0.80 ALDH1A1 (0.47) ALDH1A1ACHEESR1ESR2CRHBP
SCHEMBL28762446 0.77 ACHE (0.35) ALDH1A1ACHEESR1ESR2MEN1
SCHEMBL6759020 0.77 CYP2A6 (0.33) ALDH1A1HPRT1

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
US-7482490-B2 Amine compound having fluorene group as framework, process for producing the amine compound, and use of the amine compound TOSOH CORPORATION (JP) 2009-01-27 US claimed
US-20080194878-A1 Amine Compound Having Fluorene Group as Framework, Process for Producing the Amine Compound, and Use of the Amine Compound TOSOH CORPORATION (JP) 2008-08-14 US claimed
EP-1752440-A1 AMINE COMPOUND HAVING FLUORENE GROUP AS FRAMEWORK, PROCESS FOR PRODUCING THE AMINE COMPOUND, AND USE OF THE AMINE COMPOUND Tosoh Corporation (JP) 2007-02-14 EP claimed
CN-111819169-B Material for organic electroluminescent device 默克专利有限公司 2024-06-14 CN disclosed
US-7482490-B2 Amine compound having fluorene group as framework, process for producing the amine compound, and use of the amine compound TOSOH CORPORATION (JP) 2009-01-27 US disclosed
US-20080194878-A1 Amine Compound Having Fluorene Group as Framework, Process for Producing the Amine Compound, and Use of the Amine Compound TOSOH CORPORATION (JP) 2008-08-14 US disclosed
EP-1752440-A1 AMINE COMPOUND HAVING FLUORENE GROUP AS FRAMEWORK, PROCESS FOR PRODUCING THE AMINE COMPOUND, AND USE OF THE AMINE COMPOUND Tosoh Corporation (JP) 2007-02-14 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-20080194878-A1 Amine Compound Having Fluorene Group as Framework, Process for Producing the Amine Compound, and Use of the Amine Compound TAAR1, SLC18A1, ADRB2 ALDH1A1 1351/4885ACHE 2539/4885ESR1 521/4885

“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.