SCHEMBL5750574

SCHEMBL5750574

CN1CCCN(C)C1=NCCN=C1N(C)CCCN1C

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
INMT O95050 5/20 0.39
BRD4 O60885 1/20 0.33
BRD2 P25440 1/20 0.33
APOBEC3A P31941 1/20 0.30
CTDSP1 Q9GZU7 1/20 0.30
APOBEC3G Q9HC16 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
SCHEMBL5748367 0.90 INMT (0.37) INMTBRD4BRD2
SCHEMBL5747811 0.90 INMT (0.37) INMTBRD4BRD2
SCHEMBL5935353 0.89 INMT (0.36) INMT
SCHEMBL5747791 0.88 INMT (0.35) INMTBRD4BRD2
SCHEMBL5748137 0.88 INMT (0.35) INMTBRD4BRD2
SCHEMBL5935344 0.84 INMT (0.33) INMT
SCHEMBL5744738 0.84 INMT (0.33) INMTBRD4BRD2
SCHEMBL5749814 0.84 INMT (0.33) INMTBRD4BRD2
SCHEMBL5748581 0.83 INMT (0.32) INMT
SCHEMBL5748621 0.80 SIGMAR1 (0.31) INMT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060272107-A1 Hair relaxing composition comprising at least one non-hydroxide polyguanidine L'OREAL S.A. (FR) 2006-12-07 US claimed
EP-1723946-A1 Composition for straightening the hair comprising at least one multi-guanidine not being a hydroxide L'OREAL (FR) 2006-11-22 EP claimed
US-20060272107-A1 Hair relaxing composition comprising at least one non-hydroxide polyguanidine L'OREAL S.A. (FR) 2006-12-07 US disclosed
EP-1723946-A1 Composition for straightening the hair comprising at least one multi-guanidine not being a hydroxide L'OREAL (FR) 2006-11-22 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-20060272107-A1 Hair relaxing composition comprising at least one non-hydroxide polyguanidine KRT18, KIT, PLOD3 INMT 318/4885BRD4 3462/4885BRD2 3215/4885

“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.