SCHEMBL9508260

SCHEMBL9508260

Cc1ccccc1Nc1nc(Nc2ccccc2C)c2cccc(O)c2n1

nearest known ligand 0.68

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 2/20 0.54
NPC1 O15118 1/20 0.47
LMNA P02545 1/20 0.47
PKM P14618 1/20 0.47
NFKB1 P19838 1/20 0.47
RAB9A P51151 1/20 0.47
NFKB2 Q00653 1/20 0.47
RELA Q04206 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL9508882 0.91 SLC2A1 (0.46) SLC2A1
Bromide SCHEMBL9510883 0.89 SLC2A1 (0.46) SLC2A1
Hydrochloric Acid SCHEMBL9776658 0.82 SLC2A1 (0.56) SLC2A1NPC1LMNAPKMNFKB1
SCHEMBL9508885 0.81 SLC2A1 (0.57) SLC2A1
Hydrochloric Acid SCHEMBL9776703 0.80 SLC2A1 (0.56) SLC2A1
SCHEMBL9508917 0.79 SLC2A1 (0.47) SLC2A1
SCHEMBL9508265 0.79
SCHEMBL9776700 0.78 SLC2A1 (0.83) SLC2A1NPC1LMNAPKMNFKB1
SCHEMBL9776757 0.77 SLC2A1 (0.48) SLC2A1
Hydrochloric Acid SCHEMBL9776677 0.77 SLC2A1 (0.86) SLC2A1NPC1LMNAPKMNFKB1

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
EP-0404322-B1 QUINAZOLINE DERIVATIVES SMITHKLINE BEECHAM INTERCREDIT B.V. (NL) 1993-09-22 EP claimed
US-5064833-A Substituted quinazoline derivatives for use in gastrointestinal diseases SMITHKLINE BEECHAM INTERCREDIT B.V. (GB) 1991-11-12 US claimed
EP-0404322-A1 Quinazoline derivatives SMITHKLINE BEECHAM INTERCREDIT B.V. (NL) 1990-12-27 EP claimed
JP-3017068-A None JP disclosed
EP-0404322-B1 QUINAZOLINE DERIVATIVES SMITHKLINE BEECHAM INTERCREDIT B.V. (NL) 1993-09-22 EP disclosed
US-5064833-A Substituted quinazoline derivatives for use in gastrointestinal diseases SMITHKLINE BEECHAM INTERCREDIT B.V. (GB) 1991-11-12 US disclosed
JP-H0317068-A SUBSTITUTED QUAINAZOLINE DERIVATIVE SMITHKLINE BEECHAM INTERCREDIT BV 1991-01-25 JP disclosed
EP-0404322-A1 Quinazoline derivatives SMITHKLINE BEECHAM INTERCREDIT B.V. (NL) 1990-12-27 EP disclosed