SCHEMBL23055432

SCHEMBL23055432

CC1(C)CCN(c2cnc(CN)c(NCC(=O)OC(C)(C)C)n2)CC1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RET P07949 6/20 0.36
CKS1B P61024 4/20 0.35
SKP1 P63208 4/20 0.35
SKP2 Q13309 4/20 0.35
F2 P00734 1/20 0.34
F10 P00742 1/20 0.34
F7 P08709 1/20 0.34
F3 P13726 1/20 0.34
PTPN11 Q06124 4/20 0.34
PGK1 P00558 1/20 0.34
CNR1 P21554 1/20 0.33
CCNT1 O60563 1/20 0.32
PIK3R1 P27986 2/20 0.32
PIK3CA P42336 2/20 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
SCHEMBL24784245 0.83 RET (0.34) RETCKS1BSKP1SKP2F2
SCHEMBL23055428 0.69 KDM4E (0.36) RETCKS1BSKP1SKP2
SCHEMBL23639175 0.69 CKS1B (0.40) CKS1BSKP1SKP2
SCHEMBL23639161 0.69 CKS1B (0.35) RETCKS1BSKP1SKP2PTPN11
SCHEMBL20399737 0.67 RET (0.41) RETCNR1PIK3R1PIK3CA
SCHEMBL30561170 0.67 RET (0.41) RETCNR1PIK3R1PIK3CA
SCHEMBL23509006 0.65 RET (0.41) RETCNR1PIK3R1PIK3CA
SCHEMBL30671539 0.63 CKS1B (0.42) RETCKS1BSKP1SKP2
SCHEMBL29118287 0.63 CKS1B (0.42) RETCKS1BSKP1SKP2
SCHEMBL29118288 0.63 CKS1B (0.38) RETCKS1BSKP1SKP2CNR1

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-2021039961-A1 RING-FUSED PYRAZOLE DERIVATIVE 大日本住友製薬株式会社 2021-03-04 WO disclosed