SCHEMBL3897665

SCHEMBL3897665

CC(C)(C)NC(=O)CCS

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.44
HPGD P15428 1/20 0.42
ALDH1A1 P00352 5/20 0.39
POLB P06746 3/20 0.37
HDAC2 Q92769 1/20 0.37
NPC1 O15118 2/20 0.36
GAA P10253 1/20 0.36
DUT P33316 1/20 0.36
MAPT P10636 3/20 0.35
TSHR P16473 1/20 0.34
RAB9A P51151 1/20 0.34
LMNA P02545 2/20 0.33
CASP3 P42574 1/20 0.33
SENP8 Q96LD8 1/20 0.33
SENP7 Q9BQF6 1/20 0.33
SENP6 Q9GZR1 1/20 0.33
EPHX1 P07099 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33

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
SCHEMBL19171550 0.84 SMN1; SMN2 (0.50) SMN1; SMN2HPGDALDH1A1POLBHDAC2
SCHEMBL930303 0.81 ALDH1A1 (0.45) SMN1; SMN2HPGDALDH1A1POLBTSHR
SCHEMBL23967240 0.79 ALDH1A1 (0.44) SMN1; SMN2HPGDALDH1A1POLBNPC1
SCHEMBL10552445 0.79 KDM4C (0.42) SMN1; SMN2ALDH1A1TSHR
SCHEMBL3903736 0.79
SCHEMBL9116620 0.79 ALDH1A1 (0.58) SMN1; SMN2HPGDALDH1A1POLBHDAC2
SCHEMBL14270532 0.78 ALDH1A1 (0.42) SMN1; SMN2HPGDALDH1A1POLBDUT
SCHEMBL23772645 0.77 ALDH1A1 (0.56) SMN1; SMN2HPGDALDH1A1POLBHDAC2
SCHEMBL3902710 0.77 SMN1; SMN2 (0.46) SMN1; SMN2HPGDALDH1A1POLBHDAC2
SCHEMBL23772642 0.77 ALDH1A1 (0.56) SMN1; SMN2HPGDALDH1A1POLBHDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7521396-B2 Substituted (thioxo)carbonylaminophenyluracils BAYER CROPSCIENCE AG (DE) 2009-04-21 US claimed
US-20060089262-A1 Substituted (thioxo)carbonylamino phenyl uraciles BAYER CROPSCIENCE AG (DE) 2006-04-27 US claimed
EP-1503994-A1 SUBSTITUTED (THIOXO)CARBONYLAMINO PHENYL URACILES Bayer CropScience AG (DE) 2005-02-09 EP claimed
WO-2003093244-A1 SUBSTITUTED (THIOXO)CARBONYLAMINO PHENYL URACILES BAYER CROPSCIENCE AG (DE) 2003-11-13 WO claimed
US-9901567-B2 Substituted CC-1065 analogs and their conjugates SYNTARGA B.V. (NL) 2018-02-27 US disclosed
US-7521396-B2 Substituted (thioxo)carbonylaminophenyluracils BAYER CROPSCIENCE AG (DE) 2009-04-21 US disclosed
US-20060089262-A1 Substituted (thioxo)carbonylamino phenyl uraciles BAYER CROPSCIENCE AG (DE) 2006-04-27 US disclosed
EP-1503994-A1 SUBSTITUTED (THIOXO)CARBONYLAMINO PHENYL URACILES Bayer CropScience AG (DE) 2005-02-09 EP disclosed
WO-2003093244-A1 SUBSTITUTED (THIOXO)CARBONYLAMINO PHENYL URACILES BAYER CROPSCIENCE AG (DE) 2003-11-13 WO disclosed
EP-0271287-A2 Quinoline dioic acids and amides MERCK FROSST CANADA INC. (CA) 1988-06-15 EP 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-20060089262-A1 Substituted (thioxo)carbonylamino phenyl uraciles NQO2, TYMP, DPYD SMN1; SMN2 3551/4885HPGD 3438/4885ALDH1A1 196/4885

“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.