SCHEMBL3076827

SCHEMBL3076827

CC1CCCN(c2ccccc2N)C1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.65
MEN1 O00255 2/20 0.65
KMT2A Q03164 2/20 0.65
USP2 O75604 1/20 0.65
HTT P42858 2/20 0.62
KDM4E B2RXH2 1/20 0.62
KEAP1 Q14145 1/20 0.58
MAPT P10636 3/20 0.50
TP53 P04637 2/20 0.50
ADRA2C P18825 1/20 0.50
ADORA2A P29274 1/20 0.49
ADORA1 P30542 1/20 0.49
CSF1R P07333 1/20 0.45
CDK8 P49336 1/20 0.43
MAP4K4 O95819 1/20 0.43
ALDH1A1 P00352 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
LRRK2 Q5S007 1/20 0.42
TLR7 Q9NYK1 1/20 0.42

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
SCHEMBL23043941 1.00 GAA (0.65) GAAMEN1KMT2AUSP2HTT
SCHEMBL13403293 0.87 HTT (0.56) GAAMEN1KMT2AUSP2HTT
SCHEMBL11908439 0.81 KEAP1 (0.59) GAAMEN1KMT2AUSP2HTT
SCHEMBL3559010 0.81 MAPT (0.51) GAAMEN1KMT2AHTTKDM4E
SCHEMBL3435118 0.80 KEAP1 (0.58) GAAMEN1KMT2AUSP2HTT
SCHEMBL20756486 0.80 HTT (0.55) GAAMEN1KMT2AHTTKDM4E
SCHEMBL4598726 0.80 NCF1 (0.56) GAAMEN1KMT2AUSP2HTT
SCHEMBL23368536 0.80 KEAP1 (0.53) GAAMEN1KMT2AUSP2HTT
SCHEMBL29978474 0.80 KDM4E (0.70) GAAMEN1KMT2AUSP2HTT
SCHEMBL23043583 0.80 KDM4E (0.70) GAAMEN1KMT2AUSP2HTT

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-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 claimed
US-20050004112-A1 C-fms kinase inhibitors 3-DIMENSIONAL PHARMACEUTICALS, INC. 2005-01-06 US claimed
US-20220315548-A1 SMALL MOLECULE AGONISTS OF MUCOLIPIN 1 AND USES THEREOF NATIONAL CENTER FOR ADVANCING TRANSLATIONAL SCIENCES 2022-10-06 US disclosed
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
EP-1313696-A2 AMINO(OXO)ACETIC ACID PROTEIN TYROSINE PHOSPHATASE INHIBITORS ABBOTT LABORATORIES (US) 2003-05-28 EP disclosed
US-20020035137-A1 Amino (oxo) acetic acid protein tyrosine phosphatase inhibitors ABBOTT LABORATORIES 2002-03-21 US disclosed
WO-2002018323-A2 AMINO(OXO)ACETIC ACID PROTEIN TYROSINE PHOSPHATASE INHIBITORS ABBOTT LABORATORIES (US) 2002-03-07 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 (4 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-20220315548-A1 SMALL MOLECULE AGONISTS OF MUCOLIPIN 1 AND USES THEREOF MCOLN1, MCOLN2, MCOLN3 GAA 154/4885MEN1 336/4885KMT2A 3579/4885
US-20020035137-A1 Amino (oxo) acetic acid protein tyrosine phosphatase inhibitors PPM1A, PTPRO, PTP4A1 GAA 445/4885MEN1 3065/4885KMT2A 3246/4885
US-20060258666-A1 c-fms kinase inhibitors FLT3, FES, FER GAA 4492/4885MEN1 1293/4885KMT2A 990/4885
US-20050004112-A1 C-fms kinase inhibitors FLT3, FGR, FER GAA 4304/4885MEN1 1033/4885KMT2A 1086/4885

“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.