SCHEMBL2175196

SCHEMBL2175196

CCCCCOc1ccn(Cc2ccc(OC)c(OCCN3CCCC3)c2Cl)c(=O)c1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.45
MCHR1 Q99705 9/20 0.44
KCNH2 Q12809 5/20 0.43
POLB P06746 2/20 0.43
MEN1 O00255 2/20 0.41
ALDH1A1 P00352 2/20 0.41
KMT2A Q03164 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
KDM4E B2RXH2 2/20 0.41
LMNA P02545 2/20 0.41
ACHE P22303 1/20 0.40
MAOB P27338 1/20 0.40
HTR2A P28223 1/20 0.39
HTR2C P28335 1/20 0.39
HTR2B P41595 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL2176011 0.87 CNR2 (0.39) MEN1ALDH1A1KMT2AKDM4ELMNA
SCHEMBL2175566 0.87 CNR2 (0.39) MEN1ALDH1A1KMT2AKDM4ELMNA
SCHEMBL2175223 0.85 THRA (0.41) MCHR1ALDH1A1KDM4E
SCHEMBL2174906 0.83 CNR2 (0.41) ACHEMAOBSMN1; SMN2
SCHEMBL2179803 0.82 MAPK14 (0.53) MCHR1KCNH2MEN1ALDH1A1KMT2A
SCHEMBL2174968 0.80 CNR2 (0.39)
SCHEMBL2178553 0.78 MEN1 (0.40) MEN1ALDH1A1KMT2A
SCHEMBL2177989 0.75 MEN1 (0.41) MEN1ALDH1A1KMT2AKDM4ELMNA
SCHEMBL2176608 0.74 MAPK14 (0.45) ALDH1A1LMNA
SCHEMBL2178275 0.73 TLR7 (0.50) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070135465-A1 Fab I Inhibitor and Process for Preparing Same CRYSTALGENOMICS, INC. (KR) 2007-06-14 US claimed
US-7973060-B2 Fab I inhibitor and process for preparing same CRYSTALGENOMICS, INC. (KR) 2011-07-05 US disclosed
US-20070135465-A1 Fab I Inhibitor and Process for Preparing Same CRYSTALGENOMICS, INC. (KR) 2007-06-14 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 (1 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-20070135465-A1 Fab I Inhibitor and Process for Preparing Same TFPI, TFPI2, FCGRT LTA4H 2956/4885MCHR1 4586/4885KCNH2 1674/4885

“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.