SCHEMBL25909786

SCHEMBL25909786

CNc1ccc2n[nH]cc2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 3/20 0.47
APP P05067 10/20 0.37
MAPT P10636 4/20 0.37
SNCA P37840 1/20 0.37
MEN1 O00255 1/20 0.37
APAF1 O14727 1/20 0.37
NPC1 O15118 1/20 0.37
POLB P06746 1/20 0.37
PABPC1 P11940 1/20 0.37
MMP14 P50281 1/20 0.37
BLM P54132 1/20 0.37
CASP6 P55212 1/20 0.37
KMT2A Q03164 1/20 0.37
ERBB2 P04626 1/20 0.34
TERT O14746 2/20 0.33
LYN P07948 1/20 0.33
BTK Q06187 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C19 P33261 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
SCHEMBL24051978 0.85 EGFR (0.47) EGFRAPPMAPTSNCAMEN1
SCHEMBL17448067 0.77 CYP11B1 (0.41) EGFRCYP1A2CYP3A4CYP2C19
SCHEMBL12653740 0.75 CYP1A2 (0.48) MAPTMEN1POLBKMT2ACYP1A2
SCHEMBL17918989 0.73 EGFR (0.55) EGFRAPPMAPTSNCAMEN1
SCHEMBL16845655 0.72 CA12 (0.47) MEN1KMT2A
SCHEMBL12366193 0.71 CYP1A2 (0.59) EGFRMEN1NPC1POLBCASP6
SCHEMBL18003378 0.71 KDM4E (0.50) EGFRMEN1NPC1POLBKMT2A
SCHEMBL19359062 0.69 ALDH1A1 (0.48) MEN1KMT2ACYP1A2CYP3A4
SCHEMBL13415 0.69 BACE1 (0.44) MAPTMEN1PABPC1KMT2ACYP1A2
SCHEMBL16523329 0.69 BACE1 (0.44) MAPTMEN1KMT2ACYP1A2

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-2023146991-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. (US) 2023-08-03 WO disclosed