SCHEMBL21711135

SCHEMBL21711135

CNCCC1CCN(c2cc(C)nc(C)c2)C1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HRH4 Q9H3N8 7/20 0.37
▸ CHRM4 P08173 2/20 0.36
▸ ADORA2A P29274 1/20 0.36
▸ ADORA1 P30542 1/20 0.36
▸ KDM4E B2RXH2 3/20 0.35
▸ HPGD P15428 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ CARM1 Q86X55 1/20 0.34
▸ PRMT6 Q96LA8 1/20 0.34
▸ PRMT8 Q9NR22 1/20 0.34
▸ HTR3A P46098 1/20 0.34
▸ BPTF Q12830 1/20 0.33
▸ SYK P43405 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ RBP4 P02753 1/20 0.33
▸ TMEM97 Q5BJF2 1/20 0.33

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
SCHEMBL20469141 0.75 OGA (0.46) CHRM4KDM4EHPGDSYKGAA
SCHEMBL20469206 0.73 OGA (0.41) —
SCHEMBL21212231 0.72 LMNA (0.43) HRH4KDM4EHPGDHSD17B10GAA
SCHEMBL20468962 0.71 OGA (0.52) —
SCHEMBL803661 0.70 HRH4 (0.54) HRH4
SCHEMBL786310 0.69 CHKA (0.46) CARM1PRMT6
SCHEMBL14222483 0.68 CHRM4 (0.37) CHRM4
SCHEMBL24919161 0.67 NCF1 (0.41) CARM1PRMT6PRMT8HTR3A
SCHEMBL9939995 0.67 NCF1 (0.41) CARM1PRMT6PRMT8HTR3A
SCHEMBL16695435 0.66 NOTUM (0.65) KDM4EHPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200048267-A1 OGA INHIBITOR COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2020-02-13 — — 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-20200048267-A1 OGA INHIBITOR COMPOUNDS OGA, OGT, GRN HRH4 4152/4885CHRM4 3490/4885ADORA2A 3776/4885

“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.

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