SCHEMBL30263228

SCHEMBL30263228

Cn1cc(-c2csc(-c3ncccc3C(N)=O)n2)cn1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CAPN1 P07384 3/20 0.46
C1S P09871 1/20 0.45
SYK P43405 1/20 0.45
ROCK2 O75116 4/20 0.45
HSP90AA1 P07900 6/20 0.43
TGFBR1 P36897 1/20 0.43
CYP19A1 P11511 1/20 0.40
PIK3CD O00329 1/20 0.39
IRAK4 Q9NWZ3 1/20 0.39

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
SCHEMBL30263308 0.84 C1S (0.51) C1SROCK2HSP90AA1TGFBR1PIK3CD
SCHEMBL28692736 0.82 SYK (0.54) SYKROCK2HSP90AA1PIK3CD
SCHEMBL30108210 0.82 SYK (0.54) SYKROCK2HSP90AA1PIK3CD
SCHEMBL30292592 0.82 CYP19A1 (0.61) CAPN1CYP19A1
SCHEMBL14992723 0.78 CYP19A1 (0.60) CAPN1ROCK2CYP19A1
SCHEMBL30292506 0.75 CYP19A1 (0.46) CAPN1TGFBR1CYP19A1
SCHEMBL21724955 0.70 PIK3CD (0.59) SYKPIK3CD
SCHEMBL30965134 0.70 PIK3CD (0.59) SYKPIK3CD
SCHEMBL24380212 0.70 CAPN1 (0.46) CAPN1ROCK2TGFBR1CYP19A1
SCHEMBL21663730 0.70 CAPN1 (0.46) CAPN1CYP19A1

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-4161921-A1 COLLAGEN 1 TRANSLATION INHIBITORS AND METHODS OF USE THEREOF Anima Biotech Inc. (US) 2023-04-12 EP disclosed