SCHEMBL5637375

SCHEMBL5637375

C=CCNC(=S)N1CCCC[C@H](NC=O)C1=O

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.39
▸ FAAH O00519 3/20 0.37
▸ MAPT P10636 4/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ ALDH1A1 P00352 4/20 0.36
▸ LMNA P02545 1/20 0.35
▸ GAA P10253 2/20 0.35
▸ KDM4E B2RXH2 2/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ PKM P14618 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL5636583 0.86 FAAH (0.36) POLBFAAHKMT2AMEN1ALDH1A1
SCHEMBL5637370 0.85 POLB (0.39) POLBFAAHMAPTKMT2AMEN1
SCHEMBL5635930 0.85 CYP3A4 (0.37) MAPTKMT2AMEN1ALDH1A1LMNA
SCHEMBL5640440 0.84 FAAH (0.40) POLBFAAHMAPTKMT2AMEN1
SCHEMBL5639139 0.81 POLB (0.41) POLBFAAHMAPTKMT2AMEN1
SCHEMBL5640082 0.80 ADH1B (0.31) —
SCHEMBL5638385 0.78 MEN1 (0.33) KMT2AMEN1LMNA
SCHEMBL5639312 0.75 FAAH (0.37) FAAHMAPTALDH1A1GAARAB9A
SCHEMBL5638209 0.73 ADH1B (0.33) ALDH1A1SMN1; SMN2
SCHEMBL5637448 0.73 ADH1B (0.33) ALDH1A1SMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7220856-B2 Substituted quinoline CCR5 receptor antagonists SCHERING AKTIENGESELLSCHAFT (DE) 2007-05-22 — — US disclosed
US-20040072818-A1 Substituted quinoline CCR5 receptor antagonists SCHERING AKTIENGESELLSCHAFT (DE) 2004-04-15 — — 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-20040072818-A1 Substituted quinoline CCR5 receptor antagonists CCR5, CXCR3, CCR2 POLB 2325/4885FAAH 1626/4885MAPT 4213/4885

“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.

Send feedback