SCHEMBL11250877

SCHEMBL11250877

O=C1C=C(CN2CCOCC2)C(=O)C=C1CN1CCOCC1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.47
ALDH1A1 P00352 2/20 0.46
CYP2C9 P11712 1/20 0.46
ALOX15 P16050 1/20 0.46
HSD17B10 Q99714 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.44
CXCR4 P61073 1/20 0.44
CYP2A13 Q16696 6/20 0.43
HTT P42858 2/20 0.43
TYMP P19971 1/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
KCNJ1 P48048 1/20 0.41
KDM4E B2RXH2 1/20 0.40
POLB P06746 1/20 0.40

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
SCHEMBL10446125 0.91 SMN1; SMN2 (0.42) HRH3ALDH1A1CYP2C9ALOX15HSD17B10
SCHEMBL11243437 0.89 STAT3 (0.44) HRH3ALDH1A1CYP2C9ALOX15HSD17B10
SCHEMBL11773118 0.71 HRH3 (0.40) HRH3ALDH1A1CYP2C9ALOX15HSD17B10
SCHEMBL34470074 0.70 ALDH1A1 (0.43) HRH3ALDH1A1CYP2C9ALOX15HSD17B10
SCHEMBL28153702 0.70 KDM4E (0.37) HRH3ALDH1A1CYP2C9ALOX15HSD17B10
SCHEMBL22244 0.70 TP53 (0.45) HRH3ALDH1A1CYP2C9ALOX15HSD17B10
SCHEMBL28152640 0.69 TP53 (0.44) HRH3ALDH1A1CYP2C9ALOX15HSD17B10
SCHEMBL15467001 0.69 HRH3 (0.87) HRH3ALDH1A1CYP2C9ALOX15HSD17B10
SCHEMBL9041656 0.68 HRH3 (0.41) HRH3ALDH1A1CYP2C9ALOX15HSD17B10
SCHEMBL4269334 0.68 MAPK1 (0.38) HRH3ALDH1A1CYP2C9ALOX15HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4324852-A REDOX COUPLES EASTMAN KODAK COMPANY (US) 1982-04-13 US claimed
US-4201588-A NONSILVER PHOTOGRAPHIC FILMS; DISULFIDE, DIAZOANTHRONE, DIAZOPHENANTHRONE, AROMATIC AZIDE, CARBAZIDES OR QUINONES AS PHOTOREDUCTANT; EXTERNAL HYDROGEN SOURCE EASTMAN KODAK COMPANY (US) 1980-05-06 US claimed
US-4195998-A NONSILVER PHOTOGRAPHIC FILMS; DISULFIDE, DIAZOANTHRONE, DIAZOPHENANTHRONE, AROMATIC AZIDE, QUINONE OR CARBAZIDE PHOTOREDUCTANT EASTMAN KODAK COMPANY (US) 1980-04-01 US claimed
US-4332884-A USING A DIOXIME CHELATING AGENT RICOH CO., LTD. (JP) 1982-06-01 US disclosed
US-4315068-A CONTAINING A COBALT-AMMINE COMPLEX AND A DIOXIME OR A BISIMIDAZOLIN-3-ONE CHELATING AGENT; STABILITY; COLOR DILMS RICOH CO., LTD. (JP) 1982-02-09 US disclosed
US-4306014-A AMMONIA OR AMINES SUPPRESS THE COLOR-FORMING REACTION SYSTEM RICOH CO., LTD. (JP) 1981-12-15 US disclosed
US-4201588-A NONSILVER PHOTOGRAPHIC FILMS; DISULFIDE, DIAZOANTHRONE, DIAZOPHENANTHRONE, AROMATIC AZIDE, CARBAZIDES OR QUINONES AS PHOTOREDUCTANT; EXTERNAL HYDROGEN SOURCE EASTMAN KODAK COMPANY (US) 1980-05-06 US disclosed
US-4171221-A NONSILVER PHOTOGTAPHY EASTMAN KODAK COMPANY (US) 1979-10-16 US disclosed