SCHEMBL6134635

SCHEMBL6134635

COc1ccc(CC(=O)c2c(Cl)cccc2Cl)nn1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.44
NNMT P40261 1/20 0.42
FEN1 P39748 1/20 0.41
MAPT P10636 1/20 0.39
MAPK1 P28482 1/20 0.39
ALDH1A1 P00352 2/20 0.38
P2RX7 Q99572 1/20 0.37
LMNA P02545 2/20 0.37
KDM4E B2RXH2 1/20 0.36
HSD17B10 Q99714 1/20 0.36
POLB P06746 2/20 0.36
AKR1B1 P15121 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL6134262 0.85 NNMT (0.42) SMN1; SMN2NNMTALDH1A1POLBMEN1
SCHEMBL6134928 0.85 NNMT (0.42) SMN1; SMN2NNMTMEN1KMT2A
SCHEMBL6134073 0.79 PDE4D (0.45) SMN1; SMN2NNMTALDH1A1KDM4E
SCHEMBL6133460 0.79 NPC1 (0.50) SMN1; SMN2NNMTFEN1MAPTALDH1A1
SCHEMBL6134151 0.78 NNMT (0.45) SMN1; SMN2NNMTMAPTMAPK1ALDH1A1
SCHEMBL6134053 0.75 CES2 (0.51) SMN1; SMN2MAPTMAPK1ALDH1A1LMNA
SCHEMBL6134193 0.75 CTNNB1 (0.50) SMN1; SMN2NNMTMAPTLMNAKDM4E
SCHEMBL6133746 0.75 NPC1 (0.44) SMN1; SMN2NNMTFEN1ALDH1A1LMNA
SCHEMBL6133505 0.75 NPC1 (0.50) SMN1; SMN2NNMTALDH1A1LMNAKDM4E
SCHEMBL6133377 0.74 NPC1 (0.44) SMN1; SMN2NNMTMAPTALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050043315-A1 Aminopyrimidine compounds, processes for their preparation and pharmaceutical compositions containing them ASTELLAS PHARMA INC. (JP) 2005-02-24 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-20050043315-A1 Aminopyrimidine compounds, processes for their preparation and pharmaceutical compositions containing them ADORA2B, ADORA2A, ADORA1 SMN1; SMN2 366/4885NNMT 2041/4885FEN1 3228/4885

“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.