SCHEMBL6572244

SCHEMBL6572244

COc1ccc(OC)c(-c2cc(N)ccc2O)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.53
ALDH1A1 P00352 5/20 0.50
HDAC4 P56524 2/20 0.50
HDAC2 Q92769 2/20 0.50
HDAC8 Q9BY41 2/20 0.50
MEN1 O00255 2/20 0.50
MAPT P10636 2/20 0.50
THRB P10828 2/20 0.50
KMT2A Q03164 2/20 0.50
KDM4E B2RXH2 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
GAA P10253 2/20 0.50
RECQL P46063 1/20 0.50
BLM P54132 1/20 0.50
MCL1 Q07820 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
GABRA1 P14867 1/20 0.47
GABRB2 P47870 1/20 0.47
CYP19A1 P11511 1/20 0.44
CA12 O43570 1/20 0.44

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
Hydrochloric Acid SCHEMBL6786006 0.98 ALDH1A1 (0.53) NPC1ALDH1A1HDAC4HDAC2HDAC8
SCHEMBL5684954 0.89 HDAC4 (0.51) NPC1ALDH1A1HDAC4HDAC2HDAC8
Hydrochloric Acid SCHEMBL5685564 0.87 ALDH1A1 (0.51) NPC1ALDH1A1HDAC4HDAC2HDAC8
SCHEMBL6572388 0.87 ALDH1A1 (0.50) NPC1ALDH1A1MEN1MAPTTHRB
Hydrochloric Acid SCHEMBL6777421 0.86 ALDH1A1 (0.53) NPC1ALDH1A1MEN1MAPTTHRB
SCHEMBL6573395 0.84 ALDH1A1 (0.49) ALDH1A1MAPTKDM4ETDP1GABRA1
SCHEMBL6572288 0.83 ALDH1A1 (0.55) ALDH1A1HDAC4HDAC2HDAC8MEN1
SCHEMBL27613014 0.83 ALDH1A1 (0.55) NPC1ALDH1A1HDAC4HDAC2HDAC8
SCHEMBL8940685 0.83 ALDH1A1 (0.55) NPC1ALDH1A1HDAC4HDAC2HDAC8
Hydrochloric Acid SCHEMBL6571234 0.82 ALDH1A1 (0.58) ALDH1A1HDAC4HDAC2HDAC8MEN1

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 NPC1 4862/4885ALDH1A1 20/4885HDAC4 1184/4885

“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.