SCHEMBL7016795

SCHEMBL7016795

CCCCNC1CCN(c2ccnc(C)c2)CC1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 13/20 0.55
VCP P55072 1/20 0.49
CARM1 Q86X55 1/20 0.48
PRMT6 Q96LA8 1/20 0.48
PRMT8 Q9NR22 1/20 0.48
LDHA P00338 1/20 0.42
SUV39H2 Q9H5I1 2/20 0.41
KDM4E B2RXH2 1/20 0.39

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
SCHEMBL803614 0.87 CARM1 (0.46) HRH4CARM1PRMT6PRMT8LDHA
Hydrochloric Acid SCHEMBL784871 0.85 CARM1 (0.46) HRH4CARM1PRMT6PRMT8LDHA
SCHEMBL7008382 0.84 CARM1 (0.47) HRH4VCPCARM1PRMT6PRMT8
SCHEMBL7009989 0.82 CARM1 (0.47) HRH4CARM1PRMT6PRMT8LDHA
SCHEMBL803613 0.79 HRH4 (0.56) HRH4CARM1PRMT6PRMT8LDHA
SCHEMBL7107787 0.79 CARM1 (0.44) HRH4VCPCARM1PRMT6PRMT8
SCHEMBL16691285 0.78 LDHA (0.47) HRH4CARM1PRMT6PRMT8LDHA
Hydrochloric Acid SCHEMBL785467 0.78 HRH4 (0.54) HRH4CARM1PRMT6PRMT8LDHA
SCHEMBL7016109 0.77 VCP (0.57) VCPCARM1PRMT6PRMT8LDHA
SCHEMBL22886404 0.75 LDHA (0.49) HRH4LDHA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030187023-A1 Sulfone derivatives, process for their production and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2003-10-02 US disclosed
EP-1302462-A1 SULFONE DERIVATIVES, PROCESS FOR THEIR PRODUCTION AND USE THEREOF Takeda Chemical Industries, Ltd. (JP) 2003-04-16 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-20030187023-A1 Sulfone derivatives, process for their production and use thereof SULT1E1, RRS1, SHH HRH4 87/4885VCP 4310/4885CARM1 241/4885

“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.