SCHEMBL1272835

SCHEMBL1272835

CCCNCC(C)NCCC

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.42
ANPEP P15144 1/20 0.39
HTR2A P28223 1/20 0.33
ADH1B P00325 1/20 0.31
ADH1A P07327 1/20 0.31
ADH7 P40394 1/20 0.31

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
SCHEMBL26854622 0.87 SIGMAR1 (0.41) SIGMAR1HTR2A
SCHEMBL24264956 0.86 TSHR (0.44) SIGMAR1ANPEPADH1BADH1AADH7
SCHEMBL8343530 0.81 ANPEP (0.42) ANPEP
SCHEMBL1556475 0.80 TSHR (0.46) SIGMAR1ANPEPADH1BADH1AADH7
SCHEMBL15208602 0.80 ANPEP (0.41) ANPEP
SCHEMBL15208704 0.80 ANPEP (0.41) ANPEP
SCHEMBL20902982 0.79 SIGMAR1 (0.42) SIGMAR1ANPEPHTR2AADH1BADH1A
SCHEMBL13770353 0.79
SCHEMBL12330644 0.79
SCHEMBL25799170 0.79

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-20180037540-A1 DIAZADIENYL COMPOUND, RAW MATERIAL FOR FORMING THIN FILM, METHOD FOR PRODUCING THIN FILM, AND DIAZADIENE COMPOUND ADEKA CORPORATION (JP) 2018-02-08 US disclosed
EP-2285861-A2 HYPERBRANCHED POLYMERS AND OLIGOMERS COMPRISING TERMINAL AMINO GROUPS AS CURING AGENTS FOR EPOXY RESINS BASF SE (DE) 2011-02-23 EP disclosed
US-20110028603-A1 HYPERBRANCHED POLYMERS AND OLIGOMERS COMPRISING TERMINAL AMINO GROUPS AS CURING AGENTS FOR EPOXY RESINS BASF SE (DE) 2011-02-03 US disclosed
WO-2009124998-A2 HYPERBRANCHED POLYMERS AND OLIGOMERS COMPRISING TERMINAL AMINO GROUPS AS CURING AGENTS FOR EPOXY RESINS BASF SE (DE) 2009-10-15 WO disclosed
US-4528391-A Pyrazino pyrazine compounds as catalysts for preparing urethanes THE DOW CHEMICAL COMPANY (US) 1985-07-09 US disclosed
US-4291150-A INTERFACIAL POLYMERIZATION GENERAL ELECTRIC CO. (US) 1981-09-22 US disclosed
US-4179469-A Preparation of amines UOP INC. (US) 1979-12-18 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-20180037540-A1 DIAZADIENYL COMPOUND, RAW MATERIAL FOR FORMING THIN FILM, METHOD FOR PRODUCING THIN FILM, AND DIAZADIENE COMPOUND DRD4, DRD2, DRD1 SIGMAR1 1070/4885ANPEP 4230/4885HTR2A 781/4885

“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.