SCHEMBL15433136

SCHEMBL15433136

CCN(CC)CCN(C)Cc1cccc(C(=O)Nc2ccc(N3CCCCC3)cc2C(=O)NC)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.42
ALDH1A1 P00352 3/20 0.42
ACHE P22303 1/20 0.41
NPC1 O15118 4/20 0.40
RAB9A P51151 4/20 0.40
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
PARP1 P09874 1/20 0.39
MAPK1 P28482 2/20 0.39
USP2 O75604 1/20 0.39
ESR2 Q92731 1/20 0.39
TAAR1 Q96RJ0 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
SERPINE1 P05121 2/20 0.38
HPGD P15428 1/20 0.38
HTT P42858 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
QSOX1 O00391 1/20 0.38
LMNA P02545 1/20 0.38
PKM P14618 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
SCHEMBL267726 0.93 ACHE (0.41) MAPTALDH1A1ACHENPC1RAB9A
SCHEMBL5790924 0.92 SERPINE1 (0.46) MAPTALDH1A1ACHENPC1RAB9A
SCHEMBL266433 0.91 HTR6 (0.47) MAPTALDH1A1ACHENPC1RAB9A
SCHEMBL268631 0.85 ALDH1A1 (0.42) MAPTALDH1A1NPC1RAB9AKMT2A
SCHEMBL268630 0.85 ALDH1A1 (0.42) MAPTALDH1A1NPC1RAB9AKMT2A
SCHEMBL267289 0.84 ALDH1A1 (0.43) MAPTALDH1A1NPC1RAB9AKMT2A
SCHEMBL267290 0.84 ALDH1A1 (0.43) MAPTALDH1A1NPC1RAB9AKMT2A
SCHEMBL267742 0.84 SLC34A2 (0.47) MAPTALDH1A1NPC1RAB9AKMT2A
SCHEMBL268469 0.84 SLC34A2 (0.42) MAPTALDH1A1ACHENPC1RAB9A
SCHEMBL267743 0.84 SLC34A2 (0.47) MAPTALDH1A1NPC1RAB9AKMT2A

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-20140023611-A1 COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT ARDELYX, INC. 2014-01-23 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-20140023611-A1 COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT SLC10A2, SLC34A2, SLC34A3 MAPT 3270/4885ALDH1A1 3332/4885ACHE 3429/4885

“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.