SCHEMBL27329671

SCHEMBL27329671

Cc1cc2n(n1)CCNCC2

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDCD1 Q15116 1/20 0.37
CD274 Q9NZQ7 1/20 0.37
HTR2C P28335 3/20 0.37
HTR2A P28223 2/20 0.37
ADRB1 P08588 6/20 0.33
NCF1 P14598 3/20 0.33
ADRB2 P07550 1/20 0.33
CHRNB2 P17787 2/20 0.33
CHRNA4 P43681 2/20 0.33
HTR6 P50406 1/20 0.32
SOD3 P08294 1/20 0.32

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
SCHEMBL14930383 0.83 PDCD1 (0.50) PDCD1CD274HTR2CHTR2AADRB1
SCHEMBL26495272 0.79 HTR2C (0.35) PDCD1CD274HTR2CHTR2ACHRNB2
SCHEMBL24417833 0.78 HTR2C (0.37) PDCD1CD274HTR2CHTR2ANCF1
SCHEMBL20517214 0.78 HTR2C (0.37) PDCD1CD274HTR2CHTR2ACHRNB2
SCHEMBL27329663 0.77 HTR2C (0.34) PDCD1CD274HTR2CHTR2A
SCHEMBL25594644 0.77 GRM5 (0.40) PDCD1CD274HTR2CHTR2AADRB1
SCHEMBL2928676 0.76
SCHEMBL25772024 0.73 PDE10A (0.41)
SCHEMBL25827027 0.73 PDE10A (0.41)
SCHEMBL16814033 0.73 PDCD1 (0.42) PDCD1CD274HTR2CHTR2ANCF1

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-2024015251-A1 INHIBITORS OF HPK1 AND METHODS OF USE THEREOF ARCUS BIOSCIENCES, INC. (US) 2024-01-18 WO disclosed