SCHEMBL24323565

SCHEMBL24323565

Cn1ccc2ccc(/C=N/C(C)(C)C)nc21

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 1/20 0.35
CRBN Q96SW2 1/20 0.35
ALDH1A1 P00352 1/20 0.30
PLA2G1B P04054 1/20 0.30
MAPT P10636 1/20 0.30
ATG4B Q9Y4P1 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
SCHEMBL29600465 1.00 DDB1 (0.35) DDB1CRBNALDH1A1PLA2G1BMAPT
SCHEMBL24324154 0.74 CCR1 (0.47) DDB1CRBNALDH1A1
SCHEMBL6914165 0.69 NPC1 (0.38) ALDH1A1PLA2G1BMAPTATG4B
SCHEMBL3677969 0.69 NPC1 (0.38) ALDH1A1PLA2G1BMAPTATG4B
SCHEMBL15469665 0.68 DDB1 (0.37) DDB1CRBNMAPT
SCHEMBL7914425 0.65 CCR1 (0.42) DDB1CRBN
SCHEMBL30322466 0.64 DDB1 (0.39) DDB1CRBN
SCHEMBL30503575 0.64 APP (0.42) DDB1CRBNMAPT
SCHEMBL22323347 0.64 DDB1 (0.39) DDB1CRBN
SCHEMBL30545112 0.64 DDB1 (0.39) DDB1CRBN

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-2022076622-A2 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMACEUTICALS INCORPORATED (US) 2022-04-14 WO disclosed