SCHEMBL16123250

SCHEMBL16123250

C=CC(=O)Nc1csc(NC(=O)C(C)C)n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TYR P14679 1/20 0.49
▸ GSTO1 P78417 11/20 0.48
▸ LMNA P02545 2/20 0.44
▸ PI4KB Q9UBF8 1/20 0.43
▸ AOC3 Q16853 1/20 0.40
▸ CCNE1 P24864 1/20 0.39
▸ CDK2 P24941 1/20 0.39
▸ CDK5 Q00535 1/20 0.39
▸ CYP1A2 P05177 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ RXFP1 Q9HBX9 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ HPGD P15428 1/20 0.38

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
SCHEMBL17371302 0.84 PI4KB (0.59) TYRGSTO1LMNAPI4KBNPC1
SCHEMBL20987763 0.80 GSTO1 (0.48) GSTO1LMNAPI4KBGAAMEN1
SCHEMBL11508621 0.75 GSTO1 (0.48) GSTO1PI4KBALDH1A1
SCHEMBL9570949 0.73 MAPT (0.60) TYRLMNAGAANPC1RAB9A
SCHEMBL11475672 0.73 TGM2 (0.44) GSTO1LMNA
SCHEMBL27944093 0.73 TYR (0.57) TYRLMNAAOC3CCNE1CDK2
SCHEMBL4871143 0.73 TYR (0.50) TYRLMNAAOC3CCNE1CDK2
SCHEMBL16095753 0.72 GSTO1 (0.47) GSTO1PI4KB
SCHEMBL12894450 0.72 CYP1A2 (0.53) TYRLMNAAOC3CCNE1CDK2
SCHEMBL11635206 0.72 GSTO1 (0.48) GSTO1PI4KB

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-20150376208-A1 MK2 INHIBITORS AND USES THEREOF CELGENE AVILOMICS RESEARCH, INC. (US) 2015-12-31 — — US disclosed
WO-2014149164-A1 MK2 INHIBITORS AND USES THEREOF CELGENE AVILOMICS RESEARCH, INC. (US) 2014-09-25 — — WO 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 (1 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-20150376208-A1 MK2 INHIBITORS AND USES THEREOF MKNK2, DUSP2, MKNK1 TYR 3032/4885GSTO1 2225/4885LMNA 4652/4885

“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.

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