SCHEMBL24199754

SCHEMBL24199754

CCCC(C)CCc1ccc2cc[nH]c2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 1/20 0.46
TAS1R1 Q7RTX1 1/20 0.46
BACE1 P56817 4/20 0.45
MEN1 O00255 1/20 0.39
POLB P06746 1/20 0.39
MAPK1 P28482 1/20 0.39
KMT2A Q03164 1/20 0.39
AHR P35869 3/20 0.39
CMA1 P23946 1/20 0.39
TYR P14679 1/20 0.39
ACACB O00763 1/20 0.38
NLRP3 Q96P20 3/20 0.36
MAOA P21397 2/20 0.36
ENPP2 Q13822 2/20 0.36
CYP2A6 P11509 1/20 0.36
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35
HSD17B10 Q99714 1/20 0.35
CHRNB4 P30926 1/20 0.34

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
SCHEMBL13230548 0.84 BACE1 (0.49) TAS1R3TAS1R1BACE1MEN1POLB
SCHEMBL3791740 0.82 BACE1 (0.53) TAS1R3TAS1R1BACE1MEN1POLB
SCHEMBL3794968 0.79 BACE1 (0.50) TAS1R3TAS1R1BACE1MEN1POLB
Dimethylamine SCHEMBL6744099 0.78 BACE1 (0.49) TAS1R3TAS1R1BACE1MEN1POLB
SCHEMBL28523093 0.76 BACE1 (0.48) BACE1MEN1POLBMAPK1KMT2A
SCHEMBL31271 0.75 AHR (0.50) BACE1MEN1POLBMAPK1KMT2A
SCHEMBL6743711 0.74 DRD2 (0.51) BACE1KDM4EHSD17B10
SCHEMBL15980816 0.74 BACE1 (0.46) TAS1R3TAS1R1BACE1MEN1POLB
SCHEMBL13230520 0.74 ACACB (0.46) TAS1R3TAS1R1BACE1MEN1POLB
SCHEMBL28853730 0.72 MEN1 (0.53) TAS1R3TAS1R1BACE1MEN1POLB

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
EP-3939986-A1 SELECTIVE INHIBITORS OF PROTEIN ARGININE METHYLTRANSFERASE 5 (PRMT5) Prelude Therapeutics, Incorporated (US) 2022-01-19 EP disclosed