SCHEMBL5778043

SCHEMBL5778043

Nc1ccc(-c2cn3c(n2)CCCC3)cc1

nearest known ligand 0.70

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.70
ALDH1A1 P00352 3/20 0.70
WDR5 P61964 11/20 0.65
NPC1 O15118 4/20 0.65
RAB9A P51151 4/20 0.65
HTT P42858 2/20 0.65
KDM4E B2RXH2 1/20 0.63
KMT2A Q03164 2/20 0.58
GAA P10253 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
MAPT P10636 1/20 0.57
RXFP1 Q9HBX9 1/20 0.57
HRH3 Q9Y5N1 1/20 0.55
HDAC1 Q13547 1/20 0.40
HDAC2 Q92769 1/20 0.40
APP P05067 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
SCHEMBL3440357 0.84 LMNA (0.67) LMNAALDH1A1WDR5NPC1RAB9A
SCHEMBL5308466 0.84 ALDH1A1 (0.70) LMNAALDH1A1WDR5NPC1RAB9A
SCHEMBL9698908 0.84 LMNA (0.70) LMNAALDH1A1WDR5NPC1RAB9A
SCHEMBL4839937 0.83 WDR5 (0.90) LMNAALDH1A1WDR5NPC1RAB9A
SCHEMBL5778502 0.83 LMNA (0.65) LMNAALDH1A1WDR5NPC1RAB9A
SCHEMBL24517436 0.83 NPC1 (0.88) LMNAALDH1A1WDR5NPC1RAB9A
SCHEMBL18281469 0.83 LMNA (0.94) LMNAALDH1A1WDR5NPC1RAB9A
Hydrochloric Acid SCHEMBL5300777 0.81 LMNA (0.97) LMNAALDH1A1WDR5NPC1RAB9A
Hydrochloric Acid SCHEMBL5379554 0.81 LMNA (0.70) LMNAALDH1A1WDR5NPC1RAB9A
SCHEMBL20514707 0.80 ALDH1A1 (0.65) LMNAALDH1A1WDR5NPC1RAB9A

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-20060276433-A1 Hydrazone derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-12-07 US disclosed
EP-1612204-A1 HYDRAZONE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-01-04 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-20060276433-A1 Hydrazone derivative APP, PRNP, HTT LMNA 861/4885ALDH1A1 1541/4885WDR5 635/4885

“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.