SCHEMBL7468196

SCHEMBL7468196

Cc1cc2cc3c(cc2n1C)CCN3

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.43
DRD2 P14416 1/20 0.36
DRD4 P21917 1/20 0.36
ALDH1A1 P00352 4/20 0.33
MAPT P10636 3/20 0.33
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
GAA P10253 1/20 0.31
TSHR P16473 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31
KDM4E B2RXH2 2/20 0.31
GFER P55789 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HPGD P15428 1/20 0.30
ALOX15 P16050 1/20 0.30
ATM Q13315 1/20 0.30

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
SCHEMBL17427791 0.75 MEN1 (0.42) ALDH1A1MAPTMEN1KMT2ANPC1
SCHEMBL7415949 0.73 AR (0.40) ARDRD2DRD4MAPTMEN1
SCHEMBL7422651 0.69 AR (0.42) ARDRD2DRD4ALDH1A1MAPT
SCHEMBL4496862 0.69 DRD2 (0.56) ARDRD2DRD4ALDH1A1MAPT
SCHEMBL7420307 0.68 AR (0.36) ARDRD2DRD4HRH3SMN1; SMN2
SCHEMBL8261456 0.68 DRD2 (0.47) ARDRD2DRD4ALDH1A1MAPT
SCHEMBL9202117 0.67 HPGD (0.36) ARALDH1A1MAPTMEN1KMT2A
SCHEMBL7417887 0.67 AR (0.37) ARDRD2DRD4ALDH1A1MAPT
SCHEMBL7420370 0.66 HSD17B10 (0.39) ARDRD2DRD4ALDH1A1MAPT
SCHEMBL862785 0.65 ALDH1A1 (0.39) ALDH1A1MAPTMEN1KMT2ANPC1

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
WO-1994004533-A1 CONDENSED INDOLE DERIVATIVES AS 5HT2C AND 5HT2B ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1994-03-03 WO disclosed