SCHEMBL18919035

SCHEMBL18919035

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

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.43
GPR183 P32249 1/20 0.42
HTR2A P28223 1/20 0.41
MAPT P10636 1/20 0.40
ACHE P22303 1/20 0.40
DNM1 Q05193 2/20 0.40
BCL2A1 Q16548 1/20 0.39
SLC6A3 Q01959 1/20 0.38
OPRM1 P35372 4/20 0.38
SIGMAR1 Q99720 1/20 0.38
CACNA1G O43497 2/20 0.37
CACNA1H O95180 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
TSPO P30536 1/20 0.36
OPRD1 P41143 1/20 0.36
GRM2 Q14416 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
SCHEMBL18919036 1.00 CNR2 (0.43) CNR2GPR183HTR2AMAPTACHE
SCHEMBL18932680 0.92 GPR183 (0.41) CNR2GPR183HTR2AMAPTACHE
SCHEMBL18919182 0.91 GPR183 (0.42) CNR2GPR183HTR2ADNM1OPRM1
SCHEMBL18919180 0.91 GPR183 (0.42) CNR2GPR183HTR2ADNM1OPRM1
SCHEMBL18919215 0.91 DNM1 (0.43) CNR2GPR183MAPTDNM1
SCHEMBL18919214 0.91 DNM1 (0.43) CNR2GPR183MAPTDNM1
SCHEMBL18919050 0.90 CNR2 (0.44) CNR2GPR183HTR2AMAPTACHE
SCHEMBL18919051 0.90 CNR2 (0.44) CNR2GPR183HTR2AMAPTACHE
SCHEMBL18919204 0.90 KMT2A (0.43) GPR183ACHESIGMAR1
SCHEMBL18919202 0.90 KMT2A (0.43) GPR183ACHESIGMAR1

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 2724/4885GPR183 2755/4885HTR2A 1880/4885

“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.