SCHEMBL6929311

SCHEMBL6929311

C1CC(CNCC2CCOC2)CO1

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 1/20 0.38
NAMPT P43490 10/20 0.35
PDCD1 Q15116 1/20 0.35
CD274 Q9NZQ7 1/20 0.35
MAP4K4 O95819 2/20 0.33
EGLN2 Q96KS0 1/20 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
SCHEMBL8551637 0.86
SCHEMBL18236910 0.85 GPR88 (0.36) DRD4NAMPTPDCD1CD274
SCHEMBL5360130 0.83 KCNH3 (0.37) NAMPTMAP4K4
SCHEMBL5324869 0.83 SAT1 (0.38) DRD4NAMPTPDCD1CD274MAP4K4
SCHEMBL1249532 0.83 DRD4 (0.36) DRD4NAMPTPDCD1CD274MAP4K4
SCHEMBL14838846 0.80
SCHEMBL14143341 0.80
SCHEMBL321562 0.80
SCHEMBL6353032 0.80
SCHEMBL17288790 0.80

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080033154-A1 Process for Producing 3-Aminomethyltetrahydrofuran Derivative MITSUI CHEMICALS, INC. (JP) 2008-02-07 US disclosed
US-20080033154-A1 Process for Producing 3-Aminomethyltetrahydrofuran Derivative MITSUI CHEMICALS, INC. (JP) 2008-02-07 US disclosed
EP-1123270-B1 PREPARATION OF AMINES EASTMAN CHEM CO (US) 2003-12-10 EP disclosed
EP-1123270-A1 PREPARATION OF AMINES EASTMAN CHEMICAL COMPANY (US) 2001-08-16 EP disclosed
WO-2000024703-A1 PREPARATION OF AMINES EASTMAN CHEMICAL COMPANY (US) 2000-05-04 WO disclosed
US-5990323-A CONTACTING IN A REACTION ZONE A WATER-SOLUBLE ALDEHYDE, WATER, AMMONIA AND HYDROGEN IN THE PRESENCE OF A SUPPORTED RUTHENIUM CATALYST AT A TEMPERATURE OF ABOUT 60 TO 150 DEGREE C. AND A TOTAL PRESSURE OF ABOUT 7 TO 50 BAR ABSOLUTE. EASTMAN CHEMICAL COMPANY (US) 1999-11-23 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-20080033154-A1 Process for Producing 3-Aminomethyltetrahydrofuran Derivative ALAD, ACMSD, HPD DRD4 2353/4885NAMPT 585/4885PDCD1 2816/4885

“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.