SCHEMBL3550600

SCHEMBL3550600

c1cc2c3c(c1)c1c(n3CCC2)CCCCC1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 7/20 0.68
HTR2A P28223 6/20 0.68
HSD17B10 Q99714 3/20 0.65
KDM4E B2RXH2 3/20 0.65
CYP1A2 P05177 2/20 0.65
KMT2A Q03164 2/20 0.65
MEN1 O00255 1/20 0.65
TP53 P04637 1/20 0.65
CYP3A4 P08684 1/20 0.65
CYP2D6 P10635 1/20 0.65
MAPT P10636 1/20 0.65
CYP2C9 P11712 1/20 0.65
ALOX15 P16050 1/20 0.65
MAPK1 P28482 1/20 0.65
CYP2C19 P33261 1/20 0.65
TDP1 Q9NUW8 1/20 0.65
HPGD P15428 2/20 0.52
USP2 O75604 1/20 0.52
ALDH1A1 P00352 1/20 0.52
LMNA P02545 1/20 0.47

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
SCHEMBL3545060 0.98 HTR2C (0.67) HTR2CHTR2AHSD17B10KDM4ECYP1A2
SCHEMBL3539313 0.92 HTR2C (0.69) HTR2CHTR2AHSD17B10KDM4ECYP1A2
SCHEMBL3542992 0.92 HTR2C (0.69) HTR2CHTR2AHSD17B10KDM4ECYP1A2
SCHEMBL5740343 0.85 HTR2C (0.61) HTR2CHTR2AHSD17B10KDM4ECYP1A2
SCHEMBL5740802 0.84 HTR2C (0.80) HTR2CHTR2AHSD17B10KDM4ECYP1A2
SCHEMBL5740154 0.83 HTR2C (0.60) HTR2CHTR2AHSD17B10KDM4ECYP1A2
SCHEMBL5413796 0.83 HTR2C (0.60) HTR2CHTR2AHSD17B10KDM4ECYP1A2
Hydrochloric Acid SCHEMBL6495715 0.82 HTR2C (0.59) HTR2CHTR2AHSD17B10KDM4ECYP1A2
SCHEMBL5739830 0.82 HTR2C (0.80) HTR2CHTR2AHSD17B10KDM4ECYP1A2
SCHEMBL5420638 0.81 HTR2C (0.65) HTR2CHTR2AHSD17B10KDM4ECYP1A2

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 7 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 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
US-4939136-A New anellated indole derivatives DUPHAR INTERNATIONAL RESEARCH B.V. (NL) 1990-07-03 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 HTR2C 223/4885HTR2A 267/4885HSD17B10 1859/4885

“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.