SCHEMBL3539295

SCHEMBL3539295

CCCCCCC(=O)Nc1cc2c3c(c1)c1c(n3CC2)CCCCCC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.41
NAMPT P43490 2/20 0.40
MAPT P10636 1/20 0.39
SOAT2 O75908 1/20 0.38
SOAT1 P35610 1/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
THRA P10827 1/20 0.38
THRB P10828 1/20 0.38
KMT2A Q03164 1/20 0.38
BCHE P06276 5/20 0.38
ACHE P22303 5/20 0.38
ENPP2 Q13822 4/20 0.38
DGAT2 Q96PD7 1/20 0.38
PSMB11 A5LHX3 1/20 0.38
PSMA7 O14818 1/20 0.38
PSMB1 P20618 1/20 0.38
PSMA1 P25786 1/20 0.38
PSMA2 P25787 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
SCHEMBL3541848 0.99 MAPT (0.40) CNR1NAMPTMAPTSOAT2SOAT1
SCHEMBL3540288 0.96 RAB9A (0.39) NAMPTMAPTMEN1ALDH1A1LMNA
SCHEMBL3543021 0.94 BCHE (0.40) CNR1NAMPTMAPTMEN1ALDH1A1
SCHEMBL3540203 0.91 BCHE (0.39) NAMPTMAPTMEN1ALDH1A1LMNA
SCHEMBL3542109 0.82 GBA1 (0.43) MAPTMEN1ALDH1A1LMNAKMT2A
SCHEMBL3546868 0.81 HTR2C (0.43) CNR1MAPTMEN1ALDH1A1LMNA
SCHEMBL3551076 0.75 CNR2 (0.41) CNR1MAPTMEN1KMT2A
SCHEMBL16118213 0.69 LMNA (0.61) CNR1SOAT2SOAT1ALDH1A1LMNA
SCHEMBL3546148 0.68 ACHE (0.40) MAPTMEN1ALDH1A1LMNAKMT2A
SCHEMBL3867110 0.68 MAPT (0.55) MAPTALDH1A1LMNAKMT2AENPP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7662831-B2 Tetracyclic indoles as potassium channel modulators WYETH LLC (US) 2010-02-16 US claimed
US-20080027090-A1 TETRACYCLIC INDOLES AS POTASSIUM CHANNEL MODULATORS WYETH (US) 2008-01-31 US claimed
US-7662831-B2 Tetracyclic indoles as potassium channel modulators WYETH LLC (US) 2010-02-16 US disclosed
US-7662831-B2 Tetracyclic indoles as potassium channel modulators WYETH LLC (US) 2010-02-16 US disclosed
US-7662831-B2 Tetracyclic indoles as potassium channel modulators WYETH LLC (US) 2010-02-16 US disclosed
US-20080027090-A1 TETRACYCLIC INDOLES AS POTASSIUM CHANNEL MODULATORS WYETH (US) 2008-01-31 US disclosed
US-20080027090-A1 TETRACYCLIC INDOLES AS POTASSIUM CHANNEL MODULATORS WYETH (US) 2008-01-31 US disclosed
US-20080027090-A1 TETRACYCLIC INDOLES AS POTASSIUM CHANNEL MODULATORS WYETH (US) 2008-01-31 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-20080027090-A1 TETRACYCLIC INDOLES AS POTASSIUM CHANNEL MODULATORS KCNJ2, KCNA5, KCNK5 CNR1 161/4885NAMPT 2557/4885MAPT 1588/4885

“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.