SCHEMBL7855029

SCHEMBL7855029

Cc1cnc(-c2cccc3c(CC(=O)O)cccc23)o1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.45
GLA P06280 1/20 0.42
STING1 Q86WV6 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.38
GAA P10253 2/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
KDM4E B2RXH2 3/20 0.37
MAPT P10636 2/20 0.37
FAAH O00519 1/20 0.37
CYP1A2 P05177 1/20 0.37
PTGDR2 Q9Y5Y4 2/20 0.36
PTGS2 P35354 1/20 0.36
PPARG P37231 2/20 0.36
NR1H2 P55055 2/20 0.36
NR1H3 Q13133 2/20 0.36
AKR1B1 P15121 1/20 0.36
P4HTM Q9NXG6 1/20 0.35
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL10186915 0.75 PDCD1 (0.42) SMN1; SMN2GAANPC1RAB9AKMT2A
SCHEMBL7839454 0.74 KMT2A (0.47) TDP1SMN1; SMN2GAANPC1RAB9A
SCHEMBL69234 0.73 TDP1 (0.76) TDP1GLASTING1KDM4EMAPT
SCHEMBL29564952 0.73 TDP1 (0.76) TDP1GLASTING1KDM4EMAPT
SCHEMBL9510677 0.73 ALOX15 (0.50) TDP1GLASMN1; SMN2GAANPC1
SCHEMBL8109553 0.72 ALDH1A1 (0.43) TDP1KMT2AKDM4EMAPTALDH1A1
SCHEMBL9193877 0.71 TDP1 (0.61) TDP1GLASTING1SMN1; SMN2GAA
SCHEMBL11311256 0.71 TDP1 (0.53) TDP1GLASTING1SMN1; SMN2GAA
SCHEMBL12794312 0.70 EDNRB (0.39) SMN1; SMN2GAANPC1RAB9AKMT2A
SCHEMBL7849211 0.70 TYMS (0.33) TDP1GLASMN1; SMN2GAANPC1

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
EP-1140946-A2 QUINOLINE DERIVATIVES SMITHKLINE BEECHAM PLC (GB) 2001-10-10 EP disclosed
WO-2000035919-A2 QUINOLINE DERIVATIVES SMITHKLINE BEECHAM PLC (GB) 2000-06-22 WO disclosed