SCHEMBL10568498

SCHEMBL10568498

Cc1ccc(-c2cn3c(n2)CCc2ccccc2-3)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.46
LMNA P02545 7/20 0.46
KDM4E B2RXH2 8/20 0.44
MAPT P10636 7/20 0.44
HPGD P15428 3/20 0.44
HTT P42858 4/20 0.42
NPSR1 Q6W5P4 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
GLA P06280 1/20 0.42
SLC2A1 P11166 1/20 0.41
ALDH1A3 P47895 1/20 0.41
TSHR P16473 2/20 0.41
KMT2A Q03164 6/20 0.40
SMN1; SMN2 Q16637 5/20 0.40
THRB P10828 1/20 0.40
NPC1 O15118 6/20 0.40
RAB9A P51151 6/20 0.40
MEN1 O00255 4/20 0.40
MITF O75030 1/20 0.40
KDM5A P29375 1/20 0.40

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
SCHEMBL84842 0.74 MAPT (0.50) ALDH1A1LMNAKDM4EMAPTHPGD
SCHEMBL24194048 0.70 SMN1; SMN2 (0.43) ALDH1A1LMNAMAPTNPSR1KMT2A
SCHEMBL12604459 0.70 ALDH1A1 (0.50) ALDH1A1LMNAKDM4EMAPTHPGD
SCHEMBL3350602 0.68 ALDH1A1 (0.47) ALDH1A1LMNAKDM4EMAPTHPGD
SCHEMBL10571882 0.67 TSHR (0.42) ALDH1A1LMNAKDM4EMAPTHPGD
SCHEMBL18748029 0.66 TDP1 (0.41) ALDH1A1LMNAKDM4EMAPTHPGD
SCHEMBL11978686 0.64 KMT2A (0.47) MAPTHPGDKMT2ASMN1; SMN2NPC1
SCHEMBL18281469 0.63 LMNA (0.94) ALDH1A1LMNAKDM4EMAPTHPGD
SCHEMBL12307044 0.62 SMN1; SMN2 (0.54) ALDH1A1LMNAKDM4EMAPTHPGD
SCHEMBL10780626 0.62 SRD5A1 (0.41) ALDH1A1LMNAKDM4EMAPTHTT

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-4810711-A ANXIOLYTIC, ANTICONVULSANT, ANTIULCER SYNTHELABO (FR) 1989-03-07 US disclosed