SCHEMBL307106

SCHEMBL307106

CCc1cccc(S(=O)(=O)N2CCN(C)CC2)c1

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.61
MAPK1 P28482 1/20 0.57
LMNA P02545 1/20 0.57
HTT P42858 1/20 0.57
SMN1; SMN2 Q16637 2/20 0.56
USP2 O75604 1/20 0.56
APOBEC3A P31941 2/20 0.54
APOBEC3G Q9HC16 2/20 0.54
TSHR P16473 2/20 0.52
KDM4E B2RXH2 1/20 0.52
PKM P14618 1/20 0.51
KMT2A Q03164 2/20 0.51
NPC1 O15118 1/20 0.51
MEN1 O00255 1/20 0.50

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
SCHEMBL14330951 0.94 ALDH1A1 (0.53) POLBLMNASMN1; SMN2USP2TSHR
SCHEMBL12327773 0.88 ALDH1A1 (0.63) LMNAHTTSMN1; SMN2USP2TSHR
SCHEMBL2326155 0.87 POLB (0.59) POLBMAPK1LMNAHTTSMN1; SMN2
SCHEMBL256083 0.86 ALDH1A1 (0.63) LMNAHTTSMN1; SMN2USP2TSHR
SCHEMBL13804969 0.83 POLB (0.59) POLBMAPK1LMNAHTTSMN1; SMN2
SCHEMBL13804968 0.83 POLB (0.55) POLBMAPK1LMNAHTTSMN1; SMN2
SCHEMBL18617342 0.82 ALDH1A1 (0.64) POLBLMNAHTTSMN1; SMN2KDM4E
SCHEMBL20885093 0.82 PKM (0.55) LMNASMN1; SMN2PKMKMT2ANPC1
SCHEMBL20885033 0.81 ALDH1A1 (0.51) LMNASMN1; SMN2TSHRKDM4EPKM
SCHEMBL12189230 0.81 SMN1; SMN2 (0.78) POLBLMNAHTTSMN1; SMN2USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11155556-B2 Pyrimido-diazepinone kinase scaffold compounds and methods for treating PI3K-mediated disorders DANA-FARBER CANCER INSTITUTE, INC. (US) 2021-10-26 US disclosed
US-20190106424-A1 PYRIMIDO-DIAZEPINON KINASE SCAFFOLD COMPOUNDS AND METHODS FOR TREATING P13K-MEDIATED DISORDERS DANA-FARBER CANCER INSTITUTE, INC. (US) 2019-04-11 US disclosed
EP-1951684-B1 BI-ARYL META-PYRIMIDINE INHIBITORS OF KINASES TARGEGEN INC (US) 2016-07-13 EP disclosed
US-8138199-B2 Use of bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2012-03-20 US disclosed
US-8133900-B2 Use of bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2012-03-13 US disclosed
US-20110269721-A1 METHODS OF TREATING THALASSEMIA TARGEGEN, INC. (US) 2011-11-03 US disclosed
US-20110212077-A1 BI-ARYL META-PYRIMIDINE INHIBITORS OF KINASES TARGEGEN, INC. (US) 2011-09-01 US disclosed
US-20090275582-A1 Bi-Aryl Meta-Pyrimidine Inhibitors of Kinases IMPACT BIOMEDICINES, INC. 2009-11-05 US disclosed
US-7528143-B2 Bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2009-05-05 US disclosed
US-20070259904-A1 Bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2007-11-08 US disclosed
US-20070191405-A1 Bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2007-08-16 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 (7 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-20070191405-A1 Bi-aryl meta-pyrimidine inhibitors of kinases JAK2, TYK2, JAK3 POLB 1540/4885MAPK1 298/4885LMNA 4817/4885
US-20070259904-A1 Bi-aryl meta-pyrimidine inhibitors of kinases JAK2, TYK2, JAK3 POLB 1540/4885MAPK1 298/4885LMNA 4817/4885
US-20090275582-A1 Bi-Aryl Meta-Pyrimidine Inhibitors of Kinases JAK2, TYK2, JAK3 POLB 1540/4885MAPK1 298/4885LMNA 4817/4885
US-11155556-B2 Pyrimido-diazepinone kinase scaffold compounds and methods for treating PI3K-mediated disorders PI4KA, PIK3CA, PI4KB POLB 1185/4885MAPK1 420/4885LMNA 2983/4885
US-20110212077-A1 BI-ARYL META-PYRIMIDINE INHIBITORS OF KINASES JAK2, TYK2, JAK3 POLB 1540/4885MAPK1 298/4885LMNA 4817/4885
US-20110269721-A1 METHODS OF TREATING THALASSEMIA JAK2, STAT5A, STAT5B POLB 1669/4885MAPK1 2410/4885LMNA 2236/4885
US-20190106424-A1 PYRIMIDO-DIAZEPINON KINASE SCAFFOLD COMPOUNDS AND METHODS FOR TREATING P13K-MEDIATED DISORDERS PI4KA, PI4KB, PIK3CA POLB 1044/4885MAPK1 525/4885LMNA 1398/4885

“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.