SCHEMBL6755866

SCHEMBL6755866

CC(=O)Oc1c(C)c(O)cc2ccccc12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.58
▸ MAPT P10636 3/20 0.58
▸ GAA P10253 3/20 0.58
▸ HTT P42858 2/20 0.58
▸ HSD17B10 Q99714 2/20 0.58
▸ TP53 P04637 1/20 0.58
▸ TRPM4 Q8TD43 1/20 0.43
▸ ERN1 O75460 1/20 0.41
▸ BACE1 P56817 2/20 0.41
▸ ALDH1A1 P00352 4/20 0.39
▸ POLB P06746 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ APEX1 P27695 1/20 0.39
▸ RECQL P46063 1/20 0.39
▸ BLM P54132 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ HPGD P15428 3/20 0.39
▸ NPSR1 Q6W5P4 2/20 0.38
▸ NQO2 P16083 1/20 0.38

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
SCHEMBL4752091 0.83 KDM4E (0.54) KDM4EMAPTGAAHTTHSD17B10
SCHEMBL17312023 0.83 KDM4E (0.49) KDM4EMAPTGAAHTTHSD17B10
SCHEMBL6618712 0.83 KDM4E (0.49) KDM4EMAPTGAAHTTHSD17B10
SCHEMBL11211578 0.80 ERN1 (0.53) KDM4EMAPTGAATRPM4ERN1
SCHEMBL13666895 0.79 KDM4E (0.62) KDM4EMAPTGAAHTTHSD17B10
SCHEMBL5675873 0.78 KDM4E (0.54) KDM4EMAPTGAAHTTHSD17B10
SCHEMBL8582319 0.77 KDM4E (0.59) KDM4EMAPTGAAHTTHSD17B10
SCHEMBL27367553 0.76 KDM4E (0.53) KDM4EMAPTGAAHTTHSD17B10
SCHEMBL8782851 0.76 MAPT (0.49) KDM4EMAPTGAAHTTHSD17B10
SCHEMBL9713872 0.75 KDM4E (0.59) KDM4EMAPTGAAHTTHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6716257-B2 OXIDATION DYES, WHICH ARE USED FOR TREATMENT OF HUMAN HAIR WELLA AKTIENGESELLSCHAFT (DE) 2004-04-06 — — US disclosed
EP-1236460-B1 Bridged diamino pyrazoles and colouring agents containing them WELLA AG (DE) 2003-11-26 — — EP disclosed
EP-1236460-A1 Bridged diamino pyrazoles and colouring agents containing them Wella Aktiengesellschaft (DE) 2002-09-04 — — EP disclosed
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