SCHEMBL3081906

SCHEMBL3081906

CN1CCN(Cc2ccc(N3CCCCC3)c(N)c2)CC1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.54
ALDH1A1 P00352 5/20 0.50
POLB P06746 1/20 0.50
S100B P04271 1/20 0.50
CSF1R P07333 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
CHKA P35790 4/20 0.49
CA2 P00918 1/20 0.49
NCF1 P14598 1/20 0.49
PRMT6 Q96LA8 1/20 0.49
HTT P42858 2/20 0.48
KDM4E B2RXH2 2/20 0.48
GAA P10253 1/20 0.48
HRH3 Q9Y5N1 3/20 0.46
HSD17B10 Q99714 1/20 0.46
MC4R P32245 1/20 0.45

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
SCHEMBL20621828 0.83 HRH3 (0.55) LMNAALDH1A1POLBS100BNCF1
SCHEMBL3081902 0.80 HTT (0.56) LMNAALDH1A1CSF1RCHKACA2
SCHEMBL547278 0.80 LMNA (0.66) LMNAALDH1A1CHKACA2NCF1
SCHEMBL22169184 0.77 LMNA (0.62) LMNAALDH1A1CHKACA2NCF1
SCHEMBL17478861 0.77 CSF1R (0.53) LMNAALDH1A1CSF1RCHKAKDM4E
SCHEMBL17478967 0.77 ALDH1A1 (0.55) LMNAALDH1A1CSF1RCHKAKDM4E
SCHEMBL3537651 0.76 S100B (0.81) LMNAALDH1A1POLBS100BL3MBTL1
SCHEMBL13542495 0.75 ALDH1A1 (0.60) LMNAALDH1A1POLBS100BL3MBTL1
SCHEMBL358763 0.75 S100B (0.59) LMNAALDH1A1POLBS100BCSF1R
SCHEMBL12837764 0.75 ALDH1A1 (0.60) LMNAALDH1A1POLBS100BL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1631560-A2 C-FMS KINASE INHIBITORS 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) 2006-03-08 EP claimed
US-20050004112-A1 C-fms kinase inhibitors 3-DIMENSIONAL PHARMACEUTICALS, INC. 2005-01-06 US claimed
WO-2004096795-A2 C-FMS KINASE INHIBITORS 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) 2004-11-11 WO claimed
US-7790724-B2 c-fms kinase inhibitors JANSSEN PHARMACEUTICA N.V. (BE) 2010-09-07 US 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
US-20060258666-A1 c-fms kinase inhibitors JANSSEN PHARMACEUTICA N.V. (BE) 2006-11-16 US disclosed
US-20050004112-A1 C-fms kinase inhibitors 3-DIMENSIONAL PHARMACEUTICALS, INC. 2005-01-06 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-20060258666-A1 c-fms kinase inhibitors FLT3, FES, FER LMNA 2742/4885ALDH1A1 4731/4885POLB 4067/4885
US-20050004112-A1 C-fms kinase inhibitors FLT3, FGR, FER LMNA 3031/4885ALDH1A1 4574/4885POLB 4110/4885

“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.