SCHEMBL25923489

SCHEMBL25923489

CN1CC2(CC(c3nc4ccccc4s3)C2)C1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.51
MEN1 O00255 2/20 0.51
ALDH1A1 P00352 5/20 0.46
TP53 P04637 3/20 0.46
DRD2 P14416 1/20 0.46
DRD4 P21917 1/20 0.46
GRM2 Q14416 1/20 0.46
UBE2M P61081 7/20 0.44
DCUN1D1 Q96GG9 7/20 0.44
GAA P10253 2/20 0.44
CHRNA7 P36544 1/20 0.43
LMNA P02545 4/20 0.42
ALOX12 P18054 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
MAPT P10636 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
RECQL P46063 1/20 0.42

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
SCHEMBL30470569 0.81 DYRK1A (0.39) KMT2AMEN1ALDH1A1TP53UBE2M
SCHEMBL31145098 0.81 KMT2A (0.52) KMT2AMEN1ALDH1A1TP53DRD2
SCHEMBL25908578 0.81 KMT2A (0.52) KMT2AMEN1ALDH1A1TP53DRD2
SCHEMBL22004378 0.80 KMT2A (0.58) KMT2AMEN1ALDH1A1TP53DRD2
Formaldehyde SCHEMBL25322525 0.78 DYRK1A (0.39) ALDH1A1TP53UBE2MDCUN1D1LMNA
SCHEMBL13202810 0.78 KMT2A (0.63) KMT2AMEN1ALDH1A1TP53DRD2
SCHEMBL29081218 0.75 KMT2A (0.56) KMT2AMEN1ALDH1A1TP53DRD2
SCHEMBL30470488 0.75 MEN1 (0.52) KMT2AMEN1ALDH1A1TP53DRD2
SCHEMBL30469899 0.75 SNCA (0.35)
SCHEMBL9533470 0.74 KMT2A (0.77) KMT2AMEN1ALDH1A1TP53DRD2

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-2023146990-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. (US) 2023-08-03 WO disclosed