SCHEMBL11458205

SCHEMBL11458205

CCc1ccc(OCCC2CCCCN2C)cc1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.54
HRH3 Q9Y5N1 3/20 0.53
CHRNB2 P17787 1/20 0.48
CHRNA4 P43681 1/20 0.48
ESRRG P62508 5/20 0.47
ESR1 P03372 3/20 0.47
ESRRB O95718 2/20 0.46
KCNH2 Q12809 1/20 0.46

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
SCHEMBL11457885 0.97 SLC2A1 (0.56) SLC2A1HRH3CHRNB2CHRNA4ESRRG
SCHEMBL11457025 0.89 SLC2A1 (0.53) SLC2A1HRH3ESRRGESR1ESRRB
SCHEMBL11448034 0.89 KDM4E (0.51) SLC2A1HRH3ESRRGESR1ESRRB
SCHEMBL14577990 0.87 LTA4H (0.51) SLC2A1HRH3CHRNB2CHRNA4ESRRG
SCHEMBL11459353 0.86 CHRNB4 (0.55) SLC2A1CHRNB2KCNH2
SCHEMBL11455837 0.86 HRH3 (0.52) SLC2A1HRH3CHRNB2CHRNA4ESRRG
SCHEMBL13849588 0.86 CHRNB2 (0.60) CHRNB2CHRNA4
SCHEMBL11447417 0.85 SLC2A1 (0.55) SLC2A1HRH3CHRNB2CHRNA4ESRRG
SCHEMBL11448915 0.85 SLC2A1 (0.58) SLC2A1ESRRGESR1ESRRBKCNH2
SCHEMBL11466900 0.85 SLC2A1 (0.52) SLC2A1HRH3CHRNB2CHRNA4ESRRG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090124624-A1 SUBSTITUTED 1-AMINOPHTHALAZINE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC APPLICATION THEREOF SANOFI-AVENTIS (FR) 2009-05-14 US disclosed
US-20090124624-A1 SUBSTITUTED 1-AMINOPHTHALAZINE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC APPLICATION THEREOF SANOFI-AVENTIS (FR) 2009-05-14 US disclosed
US-4225608-A ANTIDEPRESSANTS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1980-09-30 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 (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-20090124624-A1 SUBSTITUTED 1-AMINOPHTHALAZINE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC APPLICATION THEREOF AGTR1, AGTR2, AHR SLC2A1 2814/4885HRH3 165/4885CHRNB2 2603/4885

“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.