SCHEMBL3096162

SCHEMBL3096162

NC(=O)c1ccccc1SC(F)(F)C(F)Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT1 Q96EB6 1/20 0.46
PDK2 Q15119 2/20 0.38
KDM4E B2RXH2 6/20 0.38
ALDH1A1 P00352 4/20 0.38
MAPT P10636 2/20 0.38
HPGD P15428 2/20 0.38
TSHR P16473 1/20 0.38
HSD17B10 Q99714 1/20 0.38
METAP2 P50579 1/20 0.36
BCAT2 O15382 1/20 0.35
IRAK4 Q9NWZ3 1/20 0.35
KEAP1 Q14145 1/20 0.35
NFE2L2 Q16236 1/20 0.35
KMT2A Q03164 1/20 0.33
ATM Q13315 1/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PBRM1 Q86U86 1/20 0.33
PARP1 P09874 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
SCHEMBL149060 0.80 SIRT1 (0.55) SIRT1PDK2KDM4EALDH1A1MAPT
SCHEMBL3096171 0.75 KMT2A (0.43) KDM4EALDH1A1MAPTHPGDTSHR
SCHEMBL22924512 0.73 SIRT1 (0.55) SIRT1PDK2KDM4EALDH1A1MAPT
SCHEMBL8626451 0.73 SIRT1 (0.55) SIRT1KDM4EALDH1A1MAPTHPGD
SCHEMBL7418361 0.70 SIRT1 (0.60) SIRT1KDM4EALDH1A1MAPTHPGD
SCHEMBL27839664 0.70 SIRT1 (0.60) SIRT1KDM4EALDH1A1MAPTHPGD
SCHEMBL3077375 0.69 SIRT1 (0.77) SIRT1KDM4EALDH1A1MAPTHPGD
SCHEMBL11821622 0.69 SIRT1 (0.64) SIRT1KDM4EALDH1A1MAPTHPGD
SCHEMBL29530768 0.69 SIRT1 (0.64) SIRT1KDM4EALDH1A1MAPTHPGD
SCHEMBL1399456 0.69 SIRT1 (0.64) SIRT1KDM4EALDH1A1MAPTHPGD

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-20050113566-A1 Inhibitors of C-FMS kinase JANSSEN PHARMACEUTICA N.V. (BE) 2005-05-26 US claimed
US-20050004112-A1 C-fms kinase inhibitors 3-DIMENSIONAL PHARMACEUTICALS, INC. 2005-01-06 US claimed
US-7790724-B2 c-fms kinase inhibitors JANSSEN PHARMACEUTICA N.V. (BE) 2010-09-07 US disclosed
EP-2016057-A1 C-FMS KINASE INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2009-01-21 EP disclosed
US-7429603-B2 Such as 5-nitro-furan-2-carboxylic acid (2-piperidin-1-yl-phenyl)-amide; diabetes, angiogenesis, psoriasis, restenosis, schizophrenia, rheumatoid arthritis, cardiovascular disease, cancer 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) 2008-09-30 US disclosed
WO-2007123516-A1 C-FMS KINASE INHIBITORS JANSSEN PHARMACEUTICA, N.V. (BE) 2007-11-01 WO disclosed
US-20060258666-A1 c-fms kinase inhibitors JANSSEN PHARMACEUTICA N.V. (BE) 2006-11-16 US disclosed
EP-1631560-A2 C-FMS KINASE INHIBITORS 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) 2006-03-08 EP disclosed
US-20050113566-A1 Inhibitors of C-FMS kinase JANSSEN PHARMACEUTICA N.V. (BE) 2005-05-26 US disclosed
US-20050004112-A1 C-fms kinase inhibitors 3-DIMENSIONAL PHARMACEUTICALS, INC. 2005-01-06 US disclosed
WO-2004096795-A2 C-FMS KINASE INHIBITORS 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) 2004-11-11 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 (3 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-20060258666-A1 c-fms kinase inhibitors FLT3, FES, FER SIRT1 4512/4885PDK2 831/4885KDM4E 1464/4885
US-20050004112-A1 C-fms kinase inhibitors FLT3, FGR, FER SIRT1 4503/4885PDK2 1114/4885KDM4E 1258/4885
US-20050113566-A1 Inhibitors of C-FMS kinase ALK, TYRO3, PDGFRB SIRT1 4152/4885PDK2 1561/4885KDM4E 2647/4885

“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.