SCHEMBL4392885

SCHEMBL4392885

CCCCC(CC)Cn1ccc2cc(OBr)ccc21

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 5/20 0.47
HTR2A P28223 4/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
PLA2G4A P47712 4/20 0.38
ITGB3 P05106 1/20 0.38
ITGAV P06756 1/20 0.38
PRMT5 O14744 5/20 0.37
MTNR1A P48039 1/20 0.36
MTNR1B P49286 1/20 0.36
ADA P00813 1/20 0.36

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
SCHEMBL3360842 0.90 HTR2C (0.59) HTR2CHTR2AKDM4EMEN1MAPT
SCHEMBL3360221 0.83 HTR2C (0.58) HTR2CHTR2APRMT5
SCHEMBL13282968 0.81 HTR2C (0.40) HTR2CHTR2APLA2G4A
SCHEMBL4403967 0.79 MTNR1A (0.46) HTR2CHTR2AKDM4EMEN1MAPT
SCHEMBL3361269 0.78 NTSR1 (0.45) HTR2CHTR2AITGB3ITGAV
SCHEMBL3360887 0.77 CDK4 (0.49) HTR2CHTR2AKDM4EMEN1MAPT
SCHEMBL29556369 0.77 CDK4 (0.49) HTR2CHTR2AKDM4EMEN1MAPT
SCHEMBL4401260 0.76 KDM4E (0.53) HTR2CHTR2AKDM4EMEN1MAPT
SCHEMBL22930091 0.73 HTR2C (0.58) HTR2CHTR2APLA2G4APRMT5
SCHEMBL4944251 0.71 HTR2C (0.68) HTR2CHTR2APRMT5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7632954-B2 Sym-N-(n-hexyl)-5-bromotriindole; Sym-N-(n-hexyl)-5-phenyltriindole; Sym-N-(n-hexyl)-[2-cyano-2-(4-pyridyl)vinyl]triindole; electrification preventions, electrification controls, capacitors, batteries, chemical sensors, displays, organic EL materials, solar cells, photodiodes, phototransistors; fibers IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2009-12-15 US disclosed
US-20070191455-A1 Substituted sym-triindole IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2007-08-16 US disclosed
EP-1717239-A1 SUBSTITUTED SYM-TRIINDOLE Ihara Chemical Industry Co., Ltd. (JP) 2006-11-02 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 (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-20070191455-A1 Substituted sym-triindole RTF1, ETF1, RTF2 HTR2C 200/4885HTR2A 74/4885KDM4E 3892/4885

“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.