SCHEMBL682774

SCHEMBL682774

CC(Cc1ccc(Cl)cc1)NCCn1cnc2c1c(=O)n(C)c(=O)n2C

nearest known ligand 0.66

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.66
MAPK1 P28482 2/20 0.66
SMN1; SMN2 Q16637 5/20 0.54
ADORA2B P29275 6/20 0.53
MAPT P10636 1/20 0.53
HTT P42858 2/20 0.53
UBE2N P61088 2/20 0.53
RXFP1 Q9HBX9 1/20 0.52
ABCC8 Q09428 1/20 0.52
KCNJ11 Q14654 1/20 0.52
GLA P06280 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
ALDH1A1 P00352 1/20 0.51
TSHR P16473 1/20 0.49

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
SCHEMBL684285 0.90 RXFP1 (0.53) LMNAMAPK1SMN1; SMN2ADORA2BMAPT
Fenethylline SCHEMBL149145 0.89 ALDH1A1 (0.65) LMNAMAPK1SMN1; SMN2ADORA2BMAPT
Fenethylline SCHEMBL121386 0.88 ALDH1A1 (0.64) LMNAMAPK1SMN1; SMN2ADORA2BMAPT
Fenethylline SCHEMBL155920 0.88 ALDH1A1 (0.64) LMNAMAPK1SMN1; SMN2ADORA2BMAPT
SCHEMBL683924 0.88 SMN1; SMN2 (0.67) LMNAMAPK1SMN1; SMN2ADORA2BMAPT
SCHEMBL683984 0.88 RXFP1 (0.63) LMNAMAPK1SMN1; SMN2ADORA2BMAPT
Fenethylline SCHEMBL14057908 0.85 ALDH1A1 (0.60) LMNAMAPK1SMN1; SMN2ADORA2BMAPT
Fenethylline SCHEMBL1934850 0.85 ALDH1A1 (0.60) LMNAMAPK1SMN1; SMN2ADORA2BMAPT
SCHEMBL682776 0.85 ADORA2B (0.50) LMNAMAPK1SMN1; SMN2ADORA2BMAPT
SCHEMBL684300 0.83 ALDH1A1 (0.55) LMNAMAPK1SMN1; SMN2ADORA2BRXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110269717-A1 NEUROGENESIS BY MODULATING ANGIOTENSIN BRAINCELLS INC. (US) 2011-11-03 US disclosed
US-20110269717-A1 NEUROGENESIS BY MODULATING ANGIOTENSIN BRAINCELLS INC. (US) 2011-11-03 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-20110269717-A1 NEUROGENESIS BY MODULATING ANGIOTENSIN NGF, DCX, BDNF LMNA 2155/4885MAPK1 470/4885SMN1; SMN2 907/4885

“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.