SCHEMBL5864941

SCHEMBL5864941

O=[N+]([O-])c1ccc(OC2CCN(c3ccncc3)CC2)c(Cl)c1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SCD O00767 1/20 0.56
ALDH1A1 P00352 5/20 0.46
MAPT P10636 8/20 0.46
LMNA P02545 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
POLB P06746 2/20 0.46
MEN1 O00255 1/20 0.46
GAA P10253 1/20 0.46
KMT2A Q03164 1/20 0.46
PDE4B Q07343 1/20 0.43
PDE4D Q08499 1/20 0.43
PDE7A Q13946 1/20 0.43
PDE7B Q9NP56 1/20 0.43
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
ENPP2 Q13822 2/20 0.42
F10 P00742 2/20 0.42
HRH3 Q9Y5N1 1/20 0.41
MAPK1 P28482 1/20 0.41

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
SCHEMBL5865001 0.88 SCD (0.53) SCDALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL5864619 0.87 SCD (0.52) SCDALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL20694191 0.86 MAPT (0.56) SCDALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL20694182 0.86 POLB (0.54) SCDALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL20694192 0.86 SCD (0.48) SCDALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL20694254 0.84 MAPT (0.67) SCDALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL20694200 0.84 SCD (0.49) SCDALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL5865147 0.84 SCD (0.67) SCDALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL20694167 0.84 ENPP2 (0.52) SCDALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL20694343 0.84 ENPP2 (0.49) SCDALDH1A1MAPTLMNASMN1; SMN2

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-7030138-B2 Benzamidine derivatives SANKYO COMPANY, LIMITED (JP) 2006-04-18 US disclosed
US-20040147555-A1 Benzamidine derivatives SANKYO COMPANY, LIMITED (JP) 2004-07-29 US disclosed
EP-1375482-A1 BENZAMIDINE DERIVATIVE Sankyo Company, Limited (JP) 2004-01-02 EP 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-20040147555-A1 Benzamidine derivatives F9, F7, F2 SCD 2794/4885ALDH1A1 1382/4885MAPT 4885/4885

“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.