SCHEMBL14258642

SCHEMBL14258642

CCCN(C)CCCCCO

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.50
ALDH1A1 P00352 2/20 0.50
HSD17B10 Q99714 1/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
TSHR P16473 1/20 0.50
SIGMAR1 Q99720 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.46
S1PR2 O95136 1/20 0.45
S1PR1 P21453 1/20 0.45
S1PR3 Q99500 1/20 0.45
S1PR5 Q9H228 1/20 0.45
CHRM2 P08172 1/20 0.44
KDM5A P29375 2/20 0.43
KDM4C Q9H3R0 2/20 0.43
DNM1 Q05193 3/20 0.40
GGPS1 O95749 3/20 0.38
PHF8 Q9UPP1 1/20 0.38

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
SCHEMBL7291512 1.00 LMNA (0.50) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL1403882 0.97 SMN1; SMN2 (0.48) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL17817522 0.90 LMNA (0.65) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL28038193 0.90 LMNA (0.65) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL1404059 0.90 LMNA (0.65) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL17817519 0.90 LMNA (0.65) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL1403835 0.90 LMNA (0.65) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL1404135 0.90
SCHEMBL465326 0.89 CHRM2 (0.52) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL8376760 0.89 CHRM2 (0.52) LMNAALDH1A1HSD17B10MEN1KMT2A

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-20080076760-A1 2,3,4,5-TETRAHYDRO-1H-1,5-BENZODIAZEPINE DERIVATIVE AND MEDICINAL COMPOSITION WAKAMOTO PHARMACEUTICAL CO., LTD (JP) 2008-03-27 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-20080076760-A1 2,3,4,5-TETRAHYDRO-1H-1,5-BENZODIAZEPINE DERIVATIVE AND MEDICINAL COMPOSITION GABRA5, GABRA1, GABRB1 LMNA 2104/4885ALDH1A1 492/4885HSD17B10 910/4885

“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.