SCHEMBL9586997

SCHEMBL9586997

CC(=O)OC(=O)c1ccc(-n2c(C)nc3cnccc32)cc1

nearest known ligand 0.62

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 1/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
HSD17B10 Q99714 1/20 0.44
POLB P06746 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL7497691 0.88 POLB (0.56) DRD1MEN1KMT2AHSD17B10POLB
SCHEMBL9384977 0.86 HSD17B10 (0.49) DRD1MEN1KMT2AHSD17B10SMN1; SMN2
SCHEMBL7869559 0.85 MEN1 (0.46) DRD1MEN1KMT2APOLB
SCHEMBL7505146 0.83 HSD17B10 (0.59) DRD1MEN1KMT2AHSD17B10POLB
SCHEMBL9335183 0.82 DRD1 (0.53) DRD1
SCHEMBL9523968 0.82 HSD17B10 (0.48) DRD1MEN1KMT2AHSD17B10SMN1; SMN2
SCHEMBL9525676 0.82 HSD17B10 (0.48) DRD1MEN1KMT2AHSD17B10SMN1; SMN2
SCHEMBL9524668 0.80 HSD17B10 (0.55) MEN1KMT2AHSD17B10SMN1; SMN2
SCHEMBL7770156 0.80 DRD1 (0.45) DRD1MEN1KMT2A
SCHEMBL8329396 0.79 MEN1 (0.46) DRD1MEN1KMT2AHSD17B10

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-5250531-A Antiallergens, antiinflammatory agents PFIZER INC. (US) 1993-10-05 US disclosed