SCHEMBL9913727

SCHEMBL9913727

CCCCNc1nc(NCCCC)nc(N2CCCC2)n1

nearest known ligand 0.75

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.75
MEN1 O00255 3/20 0.75
KMT2A Q03164 3/20 0.75
NPSR1 Q6W5P4 2/20 0.58
MAPT P10636 1/20 0.58
GBA1 P04062 11/20 0.58
SMN1; SMN2 Q16637 1/20 0.55
POLB P06746 1/20 0.52
TSHR P16473 1/20 0.49
TP53 P04637 1/20 0.46
ALDH1A1 P00352 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46

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
SCHEMBL7774642 0.98 LMNA (0.73) LMNAMEN1KMT2ANPSR1MAPT
SCHEMBL8050942 0.92 LMNA (0.69) LMNAMEN1KMT2ANPSR1MAPT
SCHEMBL7774828 0.89 LMNA (0.65) LMNAMEN1KMT2ANPSR1MAPT
SCHEMBL9913722 0.85 KMT2A (0.55) LMNAMEN1KMT2ANPSR1MAPT
SCHEMBL8054058 0.85 TSHR (0.68) LMNAMEN1KMT2AGBA1SMN1; SMN2
SCHEMBL7776363 0.83 LMNA (0.57) LMNAMEN1KMT2ANPSR1MAPT
SCHEMBL9913696 0.82 MEN1 (0.76) LMNAMEN1KMT2ANPSR1MAPT
SCHEMBL18404464 0.82 LMNA (0.55) LMNAMEN1KMT2ANPSR1MAPT
SCHEMBL14725040 0.81 TSHR (0.61) LMNAMEN1KMT2AGBA1SMN1; SMN2
SCHEMBL14725034 0.81 KMT2A (0.50) LMNAMEN1KMT2ANPSR1MAPT

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-8198387-B2 Proton-conducting compound and proton-conducting polymer NIPPON STEEL CHEMICAL CO., LTD. (JP) 2012-06-12 US disclosed
US-20100063249-A1 PROTON-CONDUCTING COMPOUND AND PROTON-CONDUCTING POLYMER NIPPON STREEL CHEMICAL CO., LTD (JP) 2010-03-11 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-20100063249-A1 PROTON-CONDUCTING COMPOUND AND PROTON-CONDUCTING POLYMER HRH3, H1-3, H1-4 LMNA 1956/4885MEN1 27/4885KMT2A 799/4885

“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.