SCHEMBL6572397

SCHEMBL6572397

COc1cc(C)ccc1-c1cc(N)ccc1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.47
ALDH1A1 P00352 4/20 0.44
CYP3A4 P08684 1/20 0.44
ACHE P22303 1/20 0.44
FYN P06241 1/20 0.44
ALOX15 P16050 1/20 0.43
HSD17B10 Q99714 1/20 0.43
MAOB P27338 1/20 0.42
LCK P06239 1/20 0.42
TP53 P04637 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
CES2 O00748 1/20 0.40
IMPDH2 P12268 1/20 0.40
IMPDH1 P20839 1/20 0.40
TSHR P16473 3/20 0.39
CA2 P00918 2/20 0.39
MAPK1 P28482 2/20 0.39
MAPT P10636 2/20 0.39
TAAR1 Q96RJ0 1/20 0.39
NR3C1 P04150 1/20 0.39

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
SCHEMBL6573395 0.87 ALDH1A1 (0.49) PDE10AALDH1A1CYP3A4ACHEFYN
SCHEMBL6572388 0.84 ALDH1A1 (0.50) PDE10AALDH1A1CYP3A4FYNHSD17B10
SCHEMBL6574549 0.83 PDE10A (0.57) PDE10AALDH1A1CYP3A4ACHEALOX15
Hydrochloric Acid SCHEMBL6777421 0.83 ALDH1A1 (0.53) PDE10AALDH1A1CYP3A4FYNTDP1
SCHEMBL6572250 0.82 PDE10A (0.61) PDE10AALDH1A1CYP3A4ACHEALOX15
SCHEMBL6011401 0.81 ALDH1A1 (0.53) ALDH1A1CYP3A4ACHEALOX15HSD17B10
SCHEMBL11950304 0.81 ACHE (0.56) ALDH1A1CYP3A4ACHEMAOBTP53
SCHEMBL6572542 0.80 CA1 (0.52) PDE10AALDH1A1FYNALOX15HSD17B10
SCHEMBL6573646 0.80 PDE10A (0.59) PDE10AALDH1A1CYP3A4ACHEALOX15
SCHEMBL6029171 0.80 ALDH1A1 (0.59) PDE10AALDH1A1CYP3A4ACHEALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1208077-B1 2-HYDROXY-5-AMINO-BIPHENYL-DERIVATIVES AND OXIDATIVE HAIR COLOURING AGENTS CONTAINING SAID COMPOUNDS WELLA AG (DE) 2004-04-21 EP claimed
US-6749644-B2 DEVELOPER AND COUPLER; WIDE RANGE OF DIFFERENT COLOR SHADES FROM BLOND TO BROWN, PURPLE, VIOLET AND EVEN BLUE AND BLACK; INTENSITY WELLA AKTIENGESELLSCHAFT (DE) 2004-06-15 US disclosed
EP-1208077-B1 2-HYDROXY-5-AMINO-BIPHENYL-DERIVATIVES AND OXIDATIVE HAIR COLOURING AGENTS CONTAINING SAID COMPOUNDS WELLA AG (DE) 2004-04-21 EP disclosed
US-20020166180-A1 2-hydroxy-5-amino-biphenyl-derivatives and oxidative hair colouring agents containing said compounds HFC PRESTIGE INTERNATIONAL OPERATIONS SWITZERLAND SÀRL (CH) 2002-11-14 US disclosed
EP-1208077-A1 2-HYDROXY-5-AMINO-BIPHENYL-DERIVATIVES AND OXIDATIVE HAIR COLOURING AGENTS CONTAINING SAID COMPOUNDS Wella Aktiengesellschaft (DE) 2002-05-29 EP disclosed
WO-2002002507-A1 2-HYDROXY-5-AMINO-BIPHENYL-DERIVATIVES AND OXIDATIVE HAIR COLOURING AGENTS CONTAINING SAID COMPOUNDS WELLA AKTIENGESELLSCHAFT (DE) 2002-01-10 WO 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-20020166180-A1 2-hydroxy-5-amino-biphenyl-derivatives and oxidative hair colouring agents containing said compounds AHR, KRT18, HMOX2 PDE10A 4026/4885ALDH1A1 20/4885CYP3A4 448/4885

“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.