SCHEMBL5486073

SCHEMBL5486073

CCN(CC)c1ccc(N)o1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.52
HTT P42858 4/20 0.52
L3MBTL1 Q9Y468 3/20 0.52
MAPK1 P28482 3/20 0.41
TDP1 Q9NUW8 2/20 0.41
PSMD14 O00487 1/20 0.41
CYP3A4 P08684 1/20 0.41
TSHR P16473 1/20 0.41
RECQL P46063 1/20 0.41
GFER P55789 1/20 0.41
MAPT P10636 9/20 0.38
MEN1 O00255 6/20 0.38
KMT2A Q03164 6/20 0.38
RAB9A P51151 3/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
S100B P04271 1/20 0.35
LMNA P02545 3/20 0.35
HPGD P15428 3/20 0.35
GAA P10253 1/20 0.34
PKM P14618 2/20 0.34

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
SCHEMBL7653003 0.68 ALDH1A1 (1.00) ALDH1A1HTTL3MBTL1MAPK1TDP1
SCHEMBL2889732 0.64
SCHEMBL11984312 0.64
SCHEMBL8467252 0.59 ALDH1A1 (1.00) ALDH1A1L3MBTL1MAPK1TDP1PSMD14
SCHEMBL33781 0.59 ALDH1A1 (1.00) ALDH1A1L3MBTL1MAPK1TDP1PSMD14
SCHEMBL7655945 0.57 ALDH1A1 (0.44) ALDH1A1L3MBTL1MAPK1TDP1PSMD14
Hydrochloric Acid SCHEMBL970321 0.57 ALDH1A1 (0.95) ALDH1A1L3MBTL1MAPK1TDP1PSMD14
Hydrochloric Acid SCHEMBL970320 0.57 ALDH1A1 (0.95) ALDH1A1L3MBTL1MAPK1TDP1PSMD14
SCHEMBL1735497 0.57 ALDH1A1 (0.74) ALDH1A1HTTL3MBTL1MAPK1TDP1
SCHEMBL31037930 0.57 HTT (0.35) ALDH1A1HTTL3MBTL1TDP1RECQL

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-7297168-B2 Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof THE PROCTER & GAMBLE COMPANY (US) 2007-11-20 US claimed
US-20050198745-A1 Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof PROCTER & GAMBLE COMPANY, THE 2005-09-15 US claimed
US-7297168-B2 Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof THE PROCTER & GAMBLE COMPANY (US) 2007-11-20 US disclosed
US-20050198745-A1 Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof PROCTER & GAMBLE COMPANY, THE 2005-09-15 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-20050198745-A1 Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof KRT18, CKMT1A; CKMT1B, CYB5R3 ALDH1A1 782/4885HTT 1441/4885L3MBTL1 4673/4885

“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.