SCHEMBL6243240

SCHEMBL6243240

COC(C(=O)C(=O)C(C)(C)C)(c1ccccc1)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CES1 P23141 1/20 0.46
▸ KCNN4 O15554 1/20 0.46
▸ MAPT P10636 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ CYP2C19 P33261 2/20 0.41
▸ HIF1A Q16665 1/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ ALOX15 P16050 1/20 0.41
▸ HDAC3 O15379 1/20 0.40
▸ HDAC4 P56524 1/20 0.40
▸ HDAC1 Q13547 1/20 0.40
▸ HDAC7 Q8WUI4 1/20 0.40
▸ HDAC2 Q92769 1/20 0.40
▸ HDAC10 Q969S8 1/20 0.40
▸ HDAC11 Q96DB2 1/20 0.40
▸ HDAC8 Q9BY41 1/20 0.40
▸ HDAC6 Q9UBN7 1/20 0.40
▸ HDAC9 Q9UKV0 1/20 0.40
▸ HDAC5 Q9UQL6 1/20 0.40
▸ MAPK1 P28482 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
SCHEMBL14881144 0.81 KCNN4 (0.50) CES1KCNN4MAPTKMT2ACYP2C19
SCHEMBL340836 0.79 KCNN4 (0.52) CES1KCNN4MAPTKMT2ACYP2C19
Hydrochloric Acid SCHEMBL8044029 0.78 KCNN4 (0.50) CES1KCNN4MAPTKMT2ACYP2C19
SCHEMBL14062648 0.78 CES1 (0.50) CES1KCNN4MAPTKMT2ACYP2C19
Ammonia Solution, Strong SCHEMBL9292403 0.78 KCNN4 (0.50) CES1KCNN4MAPTKMT2ACYP2C19
SCHEMBL342555 0.76 KCNN4 (0.64) CES1KCNN4MAPTKMT2ACYP2C19
SCHEMBL3905516 0.76 MAPT (0.55) CES1KCNN4MAPTKMT2ACYP2C19
SCHEMBL28392840 0.76 CES1 (0.48) CES1KCNN4MAPTKMT2ACYP2C19
Water SCHEMBL9292645 0.76 CES1 (0.48) CES1KCNN4MAPTKMT2ACYP2C19
SCHEMBL9292108 0.76 KCNN4 (0.48) CES1KCNN4MAPTKMT2ACYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1582201-B1 Use of asymmetrically substituted triazine derivatives for solubilising or for enhancing the solubilisation of symmetrically substituted triazine derivatives in oil compositions BEIERSDORF AG (DE) 2013-08-21 — — EP disclosed
EP-1582201-A2 Use of asymmetrically substituted triazine derivatives for solubilising or for enhancing the solubilisation of symmetrically substituted triazine derivatives in oil compositions Beiersdorf AG (DE) 2005-10-05 — — EP disclosed
EP-1559413-A2 Stable cosmetic or dermatologic compositions in the form of W/O emulsions containing asymmetrically substituted triazine derivatives Beiersdorf AG (DE) 2005-08-03 — — EP disclosed
EP-0950397-B1 Use of asymmetrically substituted triazine derivatives for solubilising or for enhancing the solubilizing of symmetrically substituted triazine derivatives BEIERSDORF AG (DE) 2005-07-27 — — EP disclosed
EP-1071394-B1 USE OF UNSYMMETRICALLY SUBSTITUTED TRIAZINE DERIVATIVES IN COSMETIC OR DERMATOLOGICAL PREPARATIONS FOR MAINTAINING THE UROCANIC ACID STATUS OF THE SKIN BEIERSDORF AG (DE) 2004-07-14 — — EP disclosed
EP-0950397-A1 Use of asymmetrically substituted triazine derivatives for solubilising or for enhancing the solubilizing of symmetrically substituted triazine derivatives Beiersdorf Aktiengesellschaft (DE) 1999-10-20 — — EP disclosed
EP-0950396-A1 Stable cosmetic or dermatologic compositions in the form of W/O emulsions containing asymmetrically substituted triazine derivatives Beiersdorf Aktiengesellschaft (DE) 1999-10-20 — — EP disclosed
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