SCHEMBL11331998

SCHEMBL11331998

NCCCCCCCCCCCCc1ccc(Cl)c(Cl)c1

nearest known ligand 0.70

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PNMT P11086 2/20 0.70
TAAR1 Q96RJ0 1/20 0.70
SIGMAR1 Q99720 5/20 0.62
IGF1R P08069 1/20 0.59
ALOX15 P16050 1/20 0.59
MEN1 O00255 1/20 0.52
CYP1A2 P05177 1/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2D6 P10635 1/20 0.52
CYP2C9 P11712 1/20 0.52
CYP2C19 P33261 1/20 0.52
KMT2A Q03164 1/20 0.52
IDO1 P14902 3/20 0.47
HRH1 P35367 2/20 0.47
MAOA P21397 1/20 0.47
PYGL P06737 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
SCHEMBL11332031 1.00 PNMT (0.70) PNMTTAAR1SIGMAR1IGF1RALOX15
SCHEMBL11338042 1.00 PNMT (0.70) PNMTTAAR1SIGMAR1IGF1RALOX15
SCHEMBL11324805 1.00 PNMT (0.70) PNMTTAAR1SIGMAR1IGF1RALOX15
SCHEMBL11338803 1.00 PNMT (0.70) PNMTTAAR1SIGMAR1IGF1RALOX15
SCHEMBL11332028 1.00 PNMT (0.70) PNMTTAAR1SIGMAR1IGF1RALOX15
SCHEMBL11332990 1.00 PNMT (0.70) PNMTTAAR1SIGMAR1IGF1RALOX15
SCHEMBL11327503 1.00 PNMT (0.70) PNMTTAAR1SIGMAR1IGF1RALOX15
SCHEMBL31497388 0.98 PNMT (0.73) PNMTTAAR1SIGMAR1IGF1RALOX15
SCHEMBL4714764 0.98 PNMT (0.73) PNMTTAAR1SIGMAR1IGF1RALOX15
SCHEMBL4037320 0.92 PNMT (0.76) PNMTTAAR1SIGMAR1IGF1RALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0002721-B1 PROCESS FOR PREPARING HYDRAZINES BAYER AG (DE) 1981-09-02 EP disclosed
EP-0002721-A2 Process for preparing hydrazines BAYER AG (DE) 1979-07-11 EP disclosed