SCHEMBL9037736

SCHEMBL9037736

CC1COC(c2ccccc2)N1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.45
▸ SLC6A2 P23975 1/20 0.42
▸ ADRA1A P35348 1/20 0.42
▸ HTR2B P41595 1/20 0.42
▸ SLC6A3 Q01959 1/20 0.42
▸ CYP2C19 P33261 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ HTR1A P08908 1/20 0.37
▸ SLC18A3 Q16572 1/20 0.36
▸ SIGMAR1 Q99720 1/20 0.36
▸ CHRNA7 P36544 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ CHRM2 P08172 4/20 0.34
▸ CHRM4 P08173 4/20 0.34
▸ CHRM1 P11229 4/20 0.34
▸ CHRM3 P20309 4/20 0.34
▸ CHRM5 P08912 3/20 0.34
▸ ADRA2A P08913 2/20 0.33

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
SCHEMBL12881421 1.00 TSHR (0.45) TSHRSLC6A2ADRA1AHTR2BSLC6A3
SCHEMBL12881466 1.00 TSHR (0.45) TSHRSLC6A2ADRA1AHTR2BSLC6A3
SCHEMBL12881447 0.76 TSHR (0.41) TSHRSLC6A2ADRA1AHTR2BSLC6A3
SCHEMBL19047014 0.72 TSHR (0.37) TSHRSLC6A2ADRA1AHTR2BSLC6A3
SCHEMBL21597984 0.72 TSHR (0.41) TSHRCYP2C19MEN1KMT2A
SCHEMBL8128459 0.71 SMN1; SMN2 (0.41) TSHRSLC6A2ADRA1AHTR2BSLC6A3
SCHEMBL7294639 0.71 SMN1; SMN2 (0.41) TSHRSLC6A2ADRA1AHTR2BSLC6A3
SCHEMBL11288518 0.71 ALDH1A1 (0.45) TSHRSLC6A2SLC6A3MEN1KMT2A
SCHEMBL8501615 0.70 ALDH1A1 (0.46) MEN1KMT2ASMN1; SMN2
SCHEMBL9666098 0.70 ESR1 (0.37) TSHR

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-2243769-B1 PROCESS FOR PRODUCTION OF OPTICALLY ACTIVE FLUOROAMINE CENTRAL GLASS CO LTD (JP) 2017-06-28 — — EP disclosed
US-8426645-B2 Process for production of optically active fluoroamine CENTRAL GLASS COMPANY, LIMITED (JP) 2013-04-23 — — US disclosed
US-8426645-B2 Process for production of optically active fluoroamine CENTRAL GLASS COMPANY, LIMITED (JP) 2013-04-23 — — US disclosed
US-20110034732-A1 Process for Production of Optically Active Fluoroamine CENTRAL GLASS COMPANY, LIMITED (JP) 2011-02-10 — — US disclosed
US-20110034732-A1 Process for Production of Optically Active Fluoroamine CENTRAL GLASS COMPANY, LIMITED (JP) 2011-02-10 — — US disclosed
EP-2243769-A1 PROCESS FOR PRODUCTION OF OPTICALLY ACTIVE FLUOROAMINE Central Glass Company, Limited (JP) 2010-10-27 — — EP disclosed
EP-0696283-A1 2-, 3-, 4-, 5-, 6-, 7-, 8-, 9- AND/OR 10-SUBSTITUTED DIBENZOXAZEPINE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND METHODS OF USE SEARLE & CO (US) 1996-02-14 — — 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-20110034732-A1 Process for Production of Optically Active Fluoroamine PHF2, HNMT, PHF8 TSHR 1945/4885SLC6A2 1284/4885ADRA1A 3226/4885

“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.

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