SCHEMBL8380993

SCHEMBL8380993

C=C(C)COc1ccccc1C(=O)OCc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.59
ALDH1A1 P00352 4/20 0.55
TDP1 Q9NUW8 3/20 0.54
KMT2A Q03164 2/20 0.52
NPSR1 Q6W5P4 2/20 0.52
MEN1 O00255 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
L3MBTL1 Q9Y468 3/20 0.51
TSHR P16473 2/20 0.51
CYP3A4 P08684 1/20 0.51
MAPK1 P28482 1/20 0.51
POLB P06746 1/20 0.50
CASP3 P42574 1/20 0.50
RAB9A P51151 1/20 0.50
SENP8 Q96LD8 1/20 0.50
SENP7 Q9BQF6 1/20 0.50
SENP6 Q9GZR1 1/20 0.50
SLC6A2 P23975 1/20 0.47
SLC6A3 Q01959 1/20 0.47
LMNA P02545 2/20 0.47

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
SCHEMBL21546007 0.86 L3MBTL1 (0.55) HTTALDH1A1TDP1KMT2ANPSR1
SCHEMBL6539750 0.85 HTT (0.65) HTTALDH1A1TDP1KMT2ANPSR1
SCHEMBL4415350 0.84 HTT (0.75) HTTALDH1A1TDP1KMT2ANPSR1
SCHEMBL27898281 0.82 L3MBTL1 (0.66) HTTALDH1A1TDP1KMT2ANPSR1
SCHEMBL6539802 0.82 HTT (0.58) HTTALDH1A1TDP1KMT2ANPSR1
SCHEMBL9574717 0.82 HTT (0.73) HTTALDH1A1TDP1KMT2ANPSR1
SCHEMBL29687865 0.82 ALDH1A1 (0.65) HTTALDH1A1TDP1KMT2ANPSR1
SCHEMBL21526676 0.82 ALDH1A1 (0.56) HTTALDH1A1TDP1KMT2ANPSR1
SCHEMBL8379922 0.81 ALDH1A1 (0.56) HTTALDH1A1KMT2ANPSR1MEN1
SCHEMBL3316012 0.81 KDM4E (0.65) HTTALDH1A1TDP1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10781275-B2 Polymerizable monomers and method of polymerizing the same ALIGN TECHNOLOGY, INC. (US) 2020-09-22 US disclosed
US-10781274-B2 Polymerizable monomers and method of polymerizing the same ALIGN TECHNOLOGY, INC. (US) 2020-09-22 US disclosed
US-20200040113-A1 POLYMERIZABLE MONOMERS AND METHOD OF POLYMERIZING THE SAME ALIGN TECHNOLOGY, INC. 2020-02-06 US disclosed
US-20190345276-A1 POLYMERIZABLE MONOMERS AND METHOD OF POLYMERIZING THE SAME TU WIEN (AT) 2019-11-14 US disclosed
US-5976558-A Silicone-containing derivatives of salicylic acid which have desquamating properties L'OREAL (FR) 1999-11-02 US disclosed
US-5906812-A USEFUL FOR TREATING INTRISIC AND EXTRINSIC AGING SUCH AS WRINKLES, FINE LINES, ACTINIC BLEMISHES, DYSCHROMIAS, DERMATITIS OR SCARS IN HUMAN SKIN; COSMETICS L'OREAL (FR) 1999-05-25 US disclosed
US-5900231-A COSMETIC AND/OR DERMATOLOGICAL SKIN TREATMENT L'OREAL (FR) 1999-05-04 US disclosed
US-5756485-A TOPICAL APPLICATION TO PREVENT AGING L'OREAL (FR) 1998-05-26 US disclosed