SCHEMBL21554053

SCHEMBL21554053

CSc1ncc(C(=O)NC(=O)c2cnc(SC)nc2NC2CC2)c(NC2CC2)n1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SYK P43405 8/20 0.50
MERTK Q12866 7/20 0.48
PDE4B Q07343 1/20 0.45
TYRO3 Q06418 6/20 0.44
FLT3 P36888 5/20 0.44
GAS6 Q14393 5/20 0.44
AXL P30530 2/20 0.43
PPARG P37231 1/20 0.42
ALDH1A1 P00352 1/20 0.42
MEN1 O00255 1/20 0.41
GABBR2 O75899 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
KMT2A Q03164 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
GABBR1 Q9UBS5 1/20 0.41

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
SCHEMBL15249748 0.87 SYK (0.51) SYKMERTKPDE4BPPARGMEN1
SCHEMBL15249749 0.86 SYK (0.65) SYK
SCHEMBL26931049 0.83 MERTK (0.57) SYKMERTKTYRO3FLT3GAS6
SCHEMBL26931042 0.83 MERTK (0.57) SYKMERTKTYRO3FLT3GAS6
SCHEMBL26161013 0.82 SYK (0.49) SYKMERTKPPARGMEN1GABBR2
SCHEMBL31360665 0.82 MEN1 (0.49) SYKMERTKALDH1A1MEN1GABBR2
SCHEMBL1226594 0.82 MEN1 (0.49) SYKMERTKPPARGMEN1GABBR2
SCHEMBL2622287 0.82 MEN1 (0.49) SYKMERTKALDH1A1MEN1GABBR2
SCHEMBL16824904 0.81 RXFP1 (0.48) SYKMERTKPDE4BALDH1A1MEN1
SCHEMBL22553618 0.81 SYK (0.46) SYKMERTKPDE4BTYRO3FLT3

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10851087-B2 Synthesis of cerdulatinib PORTOLA PHARMACEUTICALS, INC. (US) 2020-12-01 US disclosed
US-20190337930-A1 SYNTHESIS OF CERDULATINIB ALEXION PHARMACEUTICALS, INC. 2019-11-07 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20190337930-A1 SYNTHESIS OF CERDULATINIB JAK2, DCK, CERS2 SYK 644/4885MERTK 1461/4885PDE4B 2048/4885
US-10851087-B2 Synthesis of cerdulatinib JAK2, DCK, CERS2 SYK 644/4885MERTK 1461/4885PDE4B 2048/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.