SCHEMBL6928247

SCHEMBL6928247

CN(C)CCCn1ccc2cc(N)ccc21

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PRKCI P41743 1/20 0.51
NOS3 P29474 4/20 0.51
NOS1 P29475 4/20 0.51
NOS2 P35228 2/20 0.51
HTR2A P28223 3/20 0.50
HTR2C P28335 3/20 0.50
BPTF Q12830 9/20 0.49
PLG P00747 1/20 0.46
PLAU P00749 1/20 0.46
EGFR P00533 1/20 0.43
HTR1D P28221 1/20 0.42

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
SCHEMBL216229 0.91 HTR2C (0.61) PRKCINOS3NOS1NOS2HTR2A
SCHEMBL30411128 0.91 HTR2C (0.61) PRKCINOS3NOS1NOS2HTR2A
SCHEMBL1121913 0.84 NOS3 (0.53) NOS3NOS1NOS2HTR2AHTR2C
SCHEMBL5089820 0.83 PRKCI (0.56) PRKCIHTR2AHTR2CPLGPLAU
SCHEMBL16741930 0.82 EGFR (0.53) NOS3NOS1NOS2HTR2AHTR2C
SCHEMBL8127772 0.81 HTR2C (0.68) NOS3NOS1NOS2HTR2AHTR2C
SCHEMBL31312599 0.80 PRKCI (0.53) PRKCIPLGPLAUEGFR
SCHEMBL3650822 0.79 PRKCI (0.59) PRKCIHTR2AHTR2CPLGPLAU
SCHEMBL4007913 0.79 SCN9A (0.55) PRKCINOS3NOS1NOS2HTR2A
SCHEMBL30408910 0.79 SCN9A (0.55) PRKCINOS3NOS1NOS2HTR2A

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-20170166555-A1 FUNCTIONALISED AND SUBSTITUTED INDOLES AS ANTI-CANCER AGENTS NOVOGEN LIMITED (AU) 2017-06-15 US disclosed
US-20170166555-A1 FUNCTIONALISED AND SUBSTITUTED INDOLES AS ANTI-CANCER AGENTS NOVOGEN LIMITED (AU) 2017-06-15 US disclosed
US-20170166555-A1 FUNCTIONALISED AND SUBSTITUTED INDOLES AS ANTI-CANCER AGENTS NOVOGEN LIMITED (AU) 2017-06-15 US disclosed
EP-3074378-A1 FUNCTIONALISED AND SUBSTITUTED INDOLES AS ANTI-CANCER AGENTS Novogen Ltd. (AU) 2016-10-05 EP disclosed
WO-2015074123-A1 FUNCTIONALISED AND SUBSTITUTED INDOLES AS ANTI-CANCER AGENTS Novogen ltd (AU) 2015-05-28 WO disclosed
EP-1178953-B1 AROMATIC AMIDES WARNER LAMBERT CO (US) 2003-12-03 EP disclosed
EP-1178953-A1 AROMATIC AMIDES WARNER-LAMBERT COMPANY (US) 2002-02-13 EP disclosed
WO-2000068184-A1 AROMATIC AMIDES WARNER-LAMBERT COMPANY (US) 2000-11-16 WO 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-20170166555-A1 FUNCTIONALISED AND SUBSTITUTED INDOLES AS ANTI-CANCER AGENTS TPM3, TPM4, TNNI3 PRKCI 1438/4885NOS3 995/4885NOS1 1607/4885

“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.