SCHEMBL9507538

SCHEMBL9507538

CC(N)CN.CC(N)CN.[Cu]

nearest known ligand 0.91

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.91
TSHR P16473 1/20 0.44
MAPK1 P28482 1/20 0.44
OPRM1 P35372 1/20 0.35
GABRP O00591 2/20 0.32
GABRD O14764 2/20 0.32
GABRA1 P14867 2/20 0.32
GABRB1 P18505 2/20 0.32
GABRG2 P18507 2/20 0.32
GABRB3 P28472 2/20 0.32
GABRA5 P31644 2/20 0.32
GABRA3 P34903 2/20 0.32
GABRA2 P47869 2/20 0.32
GABRB2 P47870 2/20 0.32
GABRA4 P48169 2/20 0.32
GABRE P78334 2/20 0.32
GABRA6 Q16445 2/20 0.32
GABRG1 Q8N1C3 2/20 0.32
GABRG3 Q99928 2/20 0.32
GABRQ Q9UN88 2/20 0.32

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
SCHEMBL7936337 1.00
SCHEMBL757716 0.95
SCHEMBL1773428 0.95
SCHEMBL175732 0.95 ALDH1A1 (1.00) ALDH1A1TSHRMAPK1OPRM1GABRP
SCHEMBL27327 0.95
Hydrazine SCHEMBL9665685 0.91
Water SCHEMBL5799352 0.91
Hydrochloric Acid SCHEMBL2260838 0.91
Ammonia Solution, Strong SCHEMBL9250838 0.91 ALDH1A1 (0.91) ALDH1A1TSHRMAPK1OPRM1GABRP
SCHEMBL9324790 0.91 ALDH1A1 (0.91) ALDH1A1TSHRMAPK1OPRM1GABRP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0204526-B1 SILICONE ELASTOMERS XEROX CORPORATION (US) 1992-06-10 EP claimed
US-4925895-A TRANSITION METAL COMPLEX FOR OXIDATION RESISTANCE, FUSER ROLLS IN ELECTROGRAPHIC MACHINES XEROX CORPORATION (US) 1990-05-15 US claimed
US-4777087-A MIXTURE OF POLYSILOXANE AND COMPLEX OF TRANSITION METAL SALT AND LIGAND XEROX CORPORATION (US) 1988-10-11 US claimed
EP-0204526-A2 Silicone elastomers XEROX CORPORATION (US) 1986-12-10 EP claimed
EP-0293230-B1 ACIDIC GAS SENSORS NEOTRONICS LIMITED (GB) 1993-08-18 EP disclosed
EP-0204526-B1 SILICONE ELASTOMERS XEROX CORPORATION (US) 1992-06-10 EP disclosed
US-5071526-A ACIDIC GAS SENSORS AND METHOD OF USING SAME NEOTRONICS TECHNOLOGY PLC (GB) 1991-12-10 US disclosed
US-4925895-A TRANSITION METAL COMPLEX FOR OXIDATION RESISTANCE, FUSER ROLLS IN ELECTROGRAPHIC MACHINES XEROX CORPORATION (US) 1990-05-15 US disclosed
EP-0293230-A2 Acidic gas sensors NEOTRONICS LIMITED (GB) 1988-11-30 EP disclosed
US-4777087-A MIXTURE OF POLYSILOXANE AND COMPLEX OF TRANSITION METAL SALT AND LIGAND XEROX CORPORATION (US) 1988-10-11 US disclosed
EP-0204526-A2 Silicone elastomers XEROX CORPORATION (US) 1986-12-10 EP disclosed