SCHEMBL8947745

SCHEMBL8947745

CCc1nc(CCl)oc1C(=O)O

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRP O00591 1/20 0.34
GABRD O14764 1/20 0.34
GABRA1 P14867 1/20 0.34
GABRB1 P18505 1/20 0.34
GABRG2 P18507 1/20 0.34
GABRB3 P28472 1/20 0.34
GABRA5 P31644 1/20 0.34
GABRA3 P34903 1/20 0.34
GABRA2 P47869 1/20 0.34
GABRB2 P47870 1/20 0.34
GABRA4 P48169 1/20 0.34
GABRE P78334 1/20 0.34
GABRA6 Q16445 1/20 0.34
GABRG1 Q8N1C3 1/20 0.34
GABRG3 Q99928 1/20 0.34
GABRQ Q9UN88 1/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL22150534 0.79 GABRP (0.39) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL17512634 0.78 GABRP (0.40) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL21158774 0.76 SMN1; SMN2 (0.37) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL2180444 0.74 GABRP (0.43) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL22932875 0.73 DGAT1 (0.30)
SCHEMBL4675656 0.71 KDM4E (0.51) RAB9AGAAMAPTHPGD
SCHEMBL597035 0.69 DDR1 (0.41) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL5552359 0.69 GAA (0.43) NPC1RAB9AGAADDR1ALDH1A1
SCHEMBL12344817 0.68 KDM4E (0.55) NPC1RAB9AALDH1A1LMNAMAPT
SCHEMBL348144 0.67 HCRTR1 (0.35) ALDH1A1HPGD

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-5516911-A Fluorescent intracellular calcium indicators THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1996-05-14 US disclosed