SCHEMBL2980393

SCHEMBL2980393

CC1CCCCN1S(=O)(=O)c1ccc(-c2ccnc(NCCN3C(=O)NC(=O)C3(C)C)n2)s1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 3/20 0.35
MMP1 P03956 1/20 0.35
MMP2 P08253 1/20 0.35
MMP7 P09237 1/20 0.35
ALOX15 P16050 1/20 0.35
ALDH1A1 P00352 2/20 0.34
LMNA P02545 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
MAPK3 P27361 1/20 0.33
MAPK1 P28482 1/20 0.33
MMP8 P22894 4/20 0.33
CDK4 P11802 3/20 0.32
CCND1 P24385 3/20 0.32
CCND3 P30281 3/20 0.32
CDK6 Q00534 3/20 0.32
CCNT1 O60563 1/20 0.32
CDK1 P06493 1/20 0.32
CCNB1 P14635 1/20 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
SCHEMBL2982266 0.85 MAPK3 (0.34) MAPK3MAPK1MKNK1
SCHEMBL2987097 0.85 ALDH1A1 (0.42) ALDH1A1LMNAKMT2AMEN1MAPK3
SCHEMBL2986658 0.85 BRAF (0.45) MMP3ALOX15ALDH1A1LMNASMN1; SMN2
SCHEMBL2984959 0.85 LOXL2 (0.34) MAPK3MAPK1CDK1CCNB1CDK2
SCHEMBL2984187 0.81 BRAF (0.43) MMP3MMP1MMP2MMP7ALOX15
SCHEMBL2986562 0.80 HPGD (0.37) MMP3MMP1MMP2MMP7ALOX15
SCHEMBL2981644 0.80 MAPK3 (0.38) MAPK3MAPK1MKNK1
SCHEMBL2980290 0.80 AKT3 (0.34) MAPK3MAPK1CDK2
SCHEMBL2980876 0.80 IKBKB (0.37) ALDH1A1MAPK3MAPK1CDK2
SCHEMBL2986689 0.79 TSHR (0.38) ALDH1A1LMNASMN1; SMN2KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1831207-B1 AMINOPYRIMIDINE COMPOUNDS AS PLK INHIBITORS AMGEN INC (US) 2012-11-14 EP disclosed
US-7858785-B2 Aminopyrimidine compounds and methods of use AMGEN INC. (US) 2010-12-28 US disclosed
US-7786132-B2 Aminopyrimidine compounds and methods of use AMGEN INC. (US) 2010-08-31 US disclosed
US-20100010014-A1 AMINOPYRIMIDINE COMPOUNDS AND METHODS OF USE AMGEN INC. (US) 2010-01-14 US disclosed
US-20070185133-A1 Aminopyrimidine compounds and methods of use AMGEN, INC. (US) 2007-08-09 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-20100010014-A1 AMINOPYRIMIDINE COMPOUNDS AND METHODS OF USE PLK1, TYMP, TK2 MMP3 2328/4885MMP1 2677/4885MMP2 3770/4885
US-20070185133-A1 Aminopyrimidine compounds and methods of use PLK1, TYMP, TK2 MMP3 2328/4885MMP1 2677/4885MMP2 3770/4885

“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.