SCHEMBL6574562

SCHEMBL6574562

COc1cc(-c2cc(N)ccc2O)ccc1C

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FYN P06241 10/20 0.50
DHFR P00374 1/20 0.50
PDE10A Q9Y233 1/20 0.50
CHEK2 O96017 2/20 0.49
TSHR P16473 1/20 0.46
CASP1 P29466 1/20 0.46
TGFBR1 P36897 1/20 0.43
ADORA2A P29274 1/20 0.42
ADORA1 P30542 1/20 0.42
BRAF P15056 1/20 0.42
ALOX5 P09917 1/20 0.42
GABRA1 P14867 1/20 0.42
GABRB2 P47870 1/20 0.42

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
SCHEMBL6572286 0.87 KDM4E (0.49) FYNCHEK2ALOX5GABRA1GABRB2
SCHEMBL6573729 0.82 PDE10A (0.59) FYNPDE10ATSHRCASP1
SCHEMBL6573556 0.82 CASP1 (0.64) PDE10ATSHRCASP1
SCHEMBL6011248 0.81 DHFR (0.52) FYNDHFRCHEK2TSHRCASP1
Hydrochloric Acid SCHEMBL6776669 0.80 PDE10A (0.57) FYNPDE10ATSHRCASP1
SCHEMBL27478787 0.80 PDE10A (0.57) PDE10ATSHRCASP1
SCHEMBL15929639 0.80 HSD17B1 (0.50) FYNDHFRTSHR
SCHEMBL23630644 0.78 ALDH1A1 (0.55) FYNDHFRTSHRTGFBR1
SCHEMBL6011444 0.78 FYN (0.51) FYNCHEK2TSHRTGFBR1ADORA2A
SCHEMBL27962588 0.78 LCK (0.49) FYNPDE10ATSHRCASP1

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
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

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 FYN 1704/4885DHFR 106/4885PDE10A 4026/4885

“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.