SCHEMBL18919151

SCHEMBL18919151

Cc1c(C(=O)N2CCN(CCc3cccc(F)c3)CC2)c2ccccc2n1CCCN(C)C

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 6/20 0.52
HTR2A P28223 1/20 0.49
AVPR1A P37288 1/20 0.42
CNR1 P21554 1/20 0.42
MAPT P10636 1/20 0.41
SLC6A3 Q01959 1/20 0.41
OPRM1 P35372 2/20 0.40
SIGMAR1 Q99720 1/20 0.40
ALDH1A1 P00352 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL18932666 0.92 HTR2A (0.48) CNR2HTR2AMAPTSLC6A3OPRM1
SCHEMBL18919132 0.90 CNR2 (0.50) CNR2HTR2AAVPR1ACNR1SIGMAR1
SCHEMBL18919106 0.90 CNR2 (0.49) CNR2HTR2AAVPR1ACNR1SIGMAR1
SCHEMBL18919072 0.89 KMT2A (0.49) HTR2ASIGMAR1ALDH1A1SMN1; SMN2
SCHEMBL18919199 0.88 CNR2 (0.54) CNR2CNR1SIGMAR1
SCHEMBL17444528 0.85 CNR2 (0.67) CNR2CNR1
SCHEMBL17444690 0.85 CNR2 (0.59) CNR2HTR2ACNR1
SCHEMBL18919035 0.84 CNR2 (0.43) CNR2HTR2AMAPTSLC6A3OPRM1
SCHEMBL18919036 0.84 CNR2 (0.43) CNR2HTR2AMAPTSLC6A3OPRM1
SCHEMBL16739343 0.84 TSHR (0.48) CNR2MAPTALDH1A1SMN1; SMN2

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-20170157135-A1 FUNCTIONALISED AND SUBSTITUTED INDOLES AS ANTI-CANCER AGENTS NOVOGEN LIMITED (AU) 2017-06-08 US disclosed
US-20170157135-A1 FUNCTIONALISED AND SUBSTITUTED INDOLES AS ANTI-CANCER AGENTS NOVOGEN LIMITED (AU) 2017-06-08 US disclosed
US-20170157135-A1 FUNCTIONALISED AND SUBSTITUTED INDOLES AS ANTI-CANCER AGENTS NOVOGEN LIMITED (AU) 2017-06-08 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-20170157135-A1 FUNCTIONALISED AND SUBSTITUTED INDOLES AS ANTI-CANCER AGENTS TPM3, TPM4, TNNI3 CNR2 2724/4885HTR2A 1880/4885AVPR1A 4831/4885

“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.