SCHEMBL266705

SCHEMBL266705

CCCN(CCC)c1ccc(NC(=O)c2cccc(CN(C)CCN(CC)CC)c2)c(C(=O)NN)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.43
SMN1; SMN2 Q16637 3/20 0.42
CYP2C19 P33261 2/20 0.42
GFER P55789 2/20 0.42
CYP1A2 P05177 1/20 0.42
MAPT P10636 3/20 0.40
HTT P42858 2/20 0.40
LMNA P02545 2/20 0.40
HSD17B10 Q99714 2/20 0.40
F10 P00742 6/20 0.39
F2 P00734 1/20 0.39
BCHE P06276 3/20 0.37
TMEM97 Q5BJF2 3/20 0.37
SIGMAR1 Q99720 3/20 0.37
NPSR1 Q6W5P4 1/20 0.37
NPC1 O15118 1/20 0.35
ALDH1A1 P00352 1/20 0.35
ALOX15 P16050 1/20 0.35
MAPK1 P28482 1/20 0.35
RAB9A P51151 1/20 0.35

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
SCHEMBL267335 0.90 SMN1; SMN2 (0.43) ACHESMN1; SMN2CYP2C19GFERCYP1A2
SCHEMBL268514 0.82 MAPT (0.47) SMN1; SMN2MAPTHTTLMNAHSD17B10
SCHEMBL268515 0.82 MAPT (0.47) SMN1; SMN2MAPTHTTLMNAHSD17B10
SCHEMBL267726 0.81 ACHE (0.41) ACHESMN1; SMN2MAPTHTTLMNA
SCHEMBL267538 0.79 SLC34A2 (0.56) SMN1; SMN2LMNAALDH1A1
SCHEMBL274040 0.79 SLC34A2 (0.56) SMN1; SMN2LMNAALDH1A1
SCHEMBL267539 0.79 SLC34A2 (0.56) SMN1; SMN2LMNAALDH1A1
SCHEMBL267963 0.76 BCHE (0.47) ACHESMN1; SMN2LMNABCHENPC1
SCHEMBL5791817 0.75 MEN1 (0.49) SMN1; SMN2CYP2C19GFERCYP1A2MAPT
SCHEMBL15433136 0.74 MAPT (0.42) ACHESMN1; SMN2MAPTHTTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120115851-A1 COMPOUND INHIBITING IN VIVO PHOSPHORUS TRANSPORT AND MEDICINE CONTAINING THE SAME KYOWA HAKKO KIRIN CO., LTD. (JP) 2012-05-10 US disclosed
US-8134015-B2 Compound inhibiting in vivo phosphorous transport and medicine containing the same KYOWA HAKKO KIRIN CO., LTD. (JP) 2012-03-13 US disclosed
US-20060217426-A1 Compound inhibiting in vivo phosphorous transport and medicine containing the same KIRIN BEER KABUSHIKI KAISHA (JP) 2006-09-28 US disclosed
EP-1614676-A1 COMPOUND INHIBITING IN VIVO PHOSPHORUS TRANSPORT AND MEDICINE CONTAINING THE SAME KIRIN BEER KABUSHIKI KAISHA (JP) 2006-01-11 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 (2 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-20060217426-A1 Compound inhibiting in vivo phosphorous transport and medicine containing the same SLC10A6, SLC7A1, SLC10A1 ACHE 4048/4885SMN1; SMN2 3975/4885CYP2C19 1217/4885
US-20120115851-A1 COMPOUND INHIBITING IN VIVO PHOSPHORUS TRANSPORT AND MEDICINE CONTAINING THE SAME SLC34A1, SLC34A2, SLC20A2 ACHE 3423/4885SMN1; SMN2 4253/4885CYP2C19 1231/4885

“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.