SCHEMBL11360992

SCHEMBL11360992

COCCOS(=O)(=O)c1ccc(N)cc1.[NaH]

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.44
TSHR P16473 4/20 0.42
LMNA P02545 3/20 0.42
MPO P05164 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
HTR6 P50406 1/20 0.42
CA1 P00915 6/20 0.41
CA2 P00918 6/20 0.41
CA9 Q16790 5/20 0.41
CA12 O43570 4/20 0.41
CA5A P35218 2/20 0.41
CA7 P43166 2/20 0.41
CA5B Q9Y2D0 2/20 0.41
CA14 Q9ULX7 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
USP2 O75604 1/20 0.41
CA4 P22748 1/20 0.41
CA6 P23280 1/20 0.41
CA13 Q8N1Q1 1/20 0.41

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
SCHEMBL28291801 0.89 TSHR (0.52) GAATSHRLMNAMPOCYP3A4
SCHEMBL85631 0.81 ALDH1A1 (0.50) GAALMNACYP3A4CYP2C9CA1
SCHEMBL11444463 0.81 GAA (0.47) GAATSHRLMNAMPOCYP3A4
SCHEMBL14258467 0.81 KDM2B (0.43) GAALMNACA1CA2CA9
SCHEMBL28798399 0.80 GAA (0.44) GAALMNACYP3A4HTR6CA1
SCHEMBL9182366 0.80 PLCG1 (0.44) GAALMNACA1CA2CA9
Water SCHEMBL9985962 0.80 ALDH1A1 (0.49) GAALMNACYP3A4CYP2C9CA1
SCHEMBL3911054 0.79 MAPK1 (0.50) TSHRHTR6CA1CA2CA9
SCHEMBL552333 0.79 GAA (0.57) GAATSHRLMNAMPOCYP3A4
SCHEMBL11437924 0.79 CA2 (0.50) GAATSHRLMNAMPOCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4268624-A Photographic light-sensitive sheet for the color diffusion transfer process FUJI PHOTO FILM CO., LTD. (JP) 1981-05-19 US disclosed