SCHEMBL7974295

SCHEMBL7974295

NCCc1nc(O)c2c(ncn2Cc2ccccc2F)n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.40
TP53 P04637 1/20 0.40
POLB P06746 1/20 0.40
TAAR1 Q96RJ0 1/20 0.39
ADORA2A P29274 1/20 0.38
ADORA1 P30542 1/20 0.38
PDE4A P27815 5/20 0.37
PDE4B Q07343 5/20 0.37
PDE4C Q08493 5/20 0.37
PDE4D Q08499 5/20 0.37
PDE5A O76074 3/20 0.37
PDE1A P54750 3/20 0.37
PDE1B Q01064 3/20 0.37
PDE1C Q14123 3/20 0.37
PDE3B Q13370 2/20 0.37
PDE3A Q14432 2/20 0.37
ALDH1A1 P00352 3/20 0.36
PKM P14618 2/20 0.36
MAPT P10636 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL7985554 0.91 SMN1; SMN2 (0.41) LMNATP53POLBADORA2AADORA1
SCHEMBL7984440 0.87 PDE4A (0.40) LMNATP53POLBPDE4APDE4B
SCHEMBL7985637 0.84 SMN1; SMN2 (0.43) POLBADORA2AALDH1A1PKMKMT2A
SCHEMBL7988782 0.84 PDE4A (0.43) LMNATP53POLBPDE4APDE4B
Hydrochloric Acid SCHEMBL7987616 0.83 SMN1; SMN2 (0.42) POLBADORA2AALDH1A1PKMKMT2A
Hydrochloric Acid SCHEMBL7984394 0.83 PDE4A (0.42) LMNATP53POLBPDE4APDE4B
SCHEMBL7974304 0.82 MET (0.44) TAAR1ALDH1A1MEN1KMT2A
SCHEMBL7988533 0.81 TAAR1 (0.43) TAAR1L3MBTL1HSD17B13PPARG
SCHEMBL7987222 0.80 PDE4A (0.49) LMNATP53POLBPDE4APDE4B
SCHEMBL7973917 0.80 LMNA (0.40) LMNATP53POLBADORA2AADORA1

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-6310070-B1 FOR TREATING NEPHRITIS, IMPROVING PROTEINURIA DUE TO GLOMERULONEPHRITIS AND PREVENTING AGGRAVATION OF NEPHRITIS JAPAN ENERGY CORPORATION (JP) 2001-10-30 US disclosed
EP-0999211-A1 NOVEL PURINE DERIVATIVES AND MEDICINAL USE THEREOF JAPAN ENERGY CORPORATION (JP) 2000-05-10 EP disclosed