SCHEMBL7741556

SCHEMBL7741556

CCCC1CCCCCCCC1

nearest known ligand 0.70

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.70
SIGMAR1 Q99720 3/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA4 P22748 1/20 0.44
NOS3 P29474 3/20 0.43
NOS1 P29475 3/20 0.43
NOS2 P35228 3/20 0.43
HSD11B1 P28845 1/20 0.38
SHBG P04278 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL128915 1.00
SCHEMBL11227844 1.00 CYP1A2 (0.70) CYP1A2SIGMAR1CA1CA2CA4
SCHEMBL7738781 1.00 CYP1A2 (0.70) CYP1A2SIGMAR1CA1CA2CA4
SCHEMBL27988307 1.00 CYP1A2 (0.70) CYP1A2SIGMAR1CA1CA2CA4
SCHEMBL3633846 1.00 CYP1A2 (0.70) CYP1A2SIGMAR1CA1CA2CA4
SCHEMBL11726232 1.00 CYP1A2 (0.70) CYP1A2SIGMAR1CA1CA2CA4
SCHEMBL97288 1.00 CYP1A2 (0.70) CYP1A2SIGMAR1CA1CA2CA4
SCHEMBL905661 1.00 CYP1A2 (0.70) CYP1A2SIGMAR1CA1CA2CA4
Ammonia Solution, Strong SCHEMBL2254142 0.97 CYP1A2 (0.67) CYP1A2SIGMAR1CA1CA2CA4
Methane SCHEMBL16670259 0.97 CYP1A2 (0.67) CYP1A2SIGMAR1CA1CA2CA4

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
US-6410748-B1 Alicycli c group-containing monomer KABUSHIKI KAISHA TOSHIBA (JP) 2002-06-25 US disclosed
US-6291129-B1 LIGHT SENSITIVE ELEMENT WITH UNSATURATED POLYMERS KABUSHIKI KAISHA TOSHIBA (JP) 2001-09-18 US disclosed