SCHEMBL2935668

SCHEMBL2935668

O=C(O)C1CCCN1c1cc(O)ccc1F

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.42
MAPT P10636 1/20 0.42
KMT2A Q03164 3/20 0.40
SERPINE1 P05121 1/20 0.40
THRB P10828 1/20 0.40
ALOX12 P18054 1/20 0.40
ALDH1A1 P00352 2/20 0.37
NOTUM Q6P988 1/20 0.37
MEN1 O00255 1/20 0.36
KEAP1 Q14145 2/20 0.36
KDM4E B2RXH2 1/20 0.36
GLA P06280 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
MGLL Q99685 1/20 0.36
HSD17B10 Q99714 1/20 0.36
AGTR2 P50052 1/20 0.35

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
SCHEMBL2942286 0.83 SMN1; SMN2 (0.42) SMN1; SMN2MAPTKMT2ASERPINE1ALDH1A1
SCHEMBL16759937 0.81 NOTUM (0.52) SMN1; SMN2MAPTKMT2ATHRBALOX12
SCHEMBL2938359 0.80 CHRNB4 (0.43) SMN1; SMN2MAPTALDH1A1KEAP1TDP1
SCHEMBL2942471 0.79 MGLL (0.33) MGLL
SCHEMBL21864003 0.78 THRB (0.40) KMT2ATHRBALOX12ALDH1A1NOTUM
SCHEMBL2942020 0.77 MAPT (0.42) SMN1; SMN2MAPTKMT2ATHRBALOX12
SCHEMBL8140544 0.76 CCR1 (0.47) SMN1; SMN2MAPTKMT2ASERPINE1THRB
SCHEMBL7548869 0.76 CCR1 (0.47) SMN1; SMN2MAPTKMT2ASERPINE1THRB
SCHEMBL2034147 0.75 SMN1; SMN2 (0.46) SMN1; SMN2MAPTKMT2ASERPINE1THRB
SCHEMBL2938685 0.75 MAP2K7 (0.42)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7491244-B2 Oxidizing hair coloring agents containing m-aminophenol derivatives THE PROCTER & GAMBLE COMPANY (US) 2009-02-17 US claimed
WO-2007020565-A1 OXIDIZING HAIR COLORING AGENTS CONTAINING M-AMINOPHENOL DERIVATIVES THE PROCTER & GAMBLE COMPANY (US) 2007-02-22 WO claimed
US-20070033745-A1 Developer substance-coupler substance of 3-(1-pyrrolidinyl)phenol and 1,4-diaminobenzene PROCTER & GAMBLE COMPANY, THE 2007-02-15 US claimed
EP-1752192-A1 Oxidizing hair coloring agents containing m-Aminophenol derivatives Wella Aktiengesellschaft (DE) 2007-02-14 EP claimed
EP-1752192-B1 Oxidizing hair coloring agents containing m-Aminophenol derivatives PROCTER & GAMBLE (US) 2010-02-03 EP disclosed
US-7491244-B2 Oxidizing hair coloring agents containing m-aminophenol derivatives THE PROCTER & GAMBLE COMPANY (US) 2009-02-17 US disclosed
WO-2007020565-A1 OXIDIZING HAIR COLORING AGENTS CONTAINING M-AMINOPHENOL DERIVATIVES THE PROCTER & GAMBLE COMPANY (US) 2007-02-22 WO disclosed
US-20070033745-A1 Developer substance-coupler substance of 3-(1-pyrrolidinyl)phenol and 1,4-diaminobenzene PROCTER & GAMBLE COMPANY, THE 2007-02-15 US disclosed
EP-1752192-A1 Oxidizing hair coloring agents containing m-Aminophenol derivatives Wella Aktiengesellschaft (DE) 2007-02-14 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-20070033745-A1 Developer substance-coupler substance of 3-(1-pyrrolidinyl)phenol and 1,4-diaminobenzene TACR1, KRT18, AKR1C4 SMN1; SMN2 4604/4885MAPT 2140/4885KMT2A 2065/4885

“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.