SCHEMBL18874801

SCHEMBL18874801

CCCCCCC(C)(CCCC)c1c[nH]c(N)n1

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ TLR8 Q9NR97 2/20 0.33
▸ CDK1 P06493 2/20 0.32
▸ CCNB1 P14635 2/20 0.32
▸ PDPK1 O15530 1/20 0.32
▸ KMT2A Q03164 1/20 0.31
▸ TLR7 Q9NYK1 1/20 0.31
▸ CNR1 P21554 3/20 0.31
▸ CNR2 P34972 3/20 0.31
▸ KDR P35968 5/20 0.31
▸ CCNA2 P20248 1/20 0.30
▸ CDK2 P24941 1/20 0.30
▸ CCNA1 P78396 1/20 0.30

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
SCHEMBL18411002 0.83 CNR1 (0.32) TLR8CNR1CNR2
SCHEMBL25913941 0.82 KCNH2 (0.30) —
SCHEMBL21718623 0.82 CNR2 (0.33) CNR1CNR2
SCHEMBL21719828 0.81 — —
SCHEMBL21719673 0.81 GGPS1 (0.30) —
SCHEMBL21719659 0.81 XDH (0.30) —
SCHEMBL18610303 0.81 CNR1 (0.33) TLR8CNR1CNR2
SCHEMBL21719672 0.81 MEN1 (0.31) SMN1; SMN2KMT2A
SCHEMBL19261395 0.79 CNR2 (0.31) CNR2
SCHEMBL20927059 0.79 — —

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-9783507-B2 Neprilysin inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2017-10-10 — — US disclosed
US-20170137388-A1 NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2017-05-18 — — 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-20170137388-A1 NEPRILYSIN INHIBITORS MME, REN, AGTR1 LMNA 907/4885MAPT 469/4885SMN1; SMN2 588/4885

“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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