SCHEMBL4332041

SCHEMBL4332041

C=C(CCCCCCCS)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 3/20 0.54
TBXAS1 P24557 2/20 0.43
HDAC3 O15379 8/20 0.40
HDAC1 Q13547 8/20 0.40
HDAC2 Q92769 8/20 0.40
HDAC10 Q969S8 8/20 0.40
HDAC11 Q96DB2 8/20 0.40
HDAC8 Q9BY41 8/20 0.40
HDAC6 Q9UBN7 8/20 0.40
HDAC4 P56524 7/20 0.40
HDAC7 Q8WUI4 7/20 0.40
HDAC9 Q9UKV0 7/20 0.40
HDAC5 Q9UQL6 7/20 0.40
LMNA P02545 1/20 0.38
TSHR P16473 1/20 0.38
NFKB1 P19838 1/20 0.38
PMP22 Q01453 1/20 0.38
TET2 Q6N021 2/20 0.33
GSTK1 Q9Y2Q3 1/20 0.33

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
SCHEMBL4335018 1.00 FOLH1 (0.54) FOLH1TBXAS1HDAC3HDAC1HDAC2
SCHEMBL1170107 1.00 FOLH1 (0.54) FOLH1TBXAS1HDAC3HDAC1HDAC2
SCHEMBL15456556 1.00 FOLH1 (0.54) FOLH1TBXAS1HDAC3HDAC1HDAC2
SCHEMBL8332559 1.00 FOLH1 (0.54) FOLH1TBXAS1HDAC3HDAC1HDAC2
SCHEMBL8332021 1.00 FOLH1 (0.54) FOLH1TBXAS1HDAC3HDAC1HDAC2
SCHEMBL3324860 1.00 FOLH1 (0.54) FOLH1TBXAS1HDAC3HDAC1HDAC2
SCHEMBL2026776 0.98 FOLH1 (0.56) FOLH1TBXAS1HDAC3HDAC1HDAC2
SCHEMBL2022931 0.90
SCHEMBL1860769 0.87 TBXAS1 (0.50) TBXAS1HDAC11LMNATSHRNFKB1
SCHEMBL3125930 0.87 TBXAS1 (0.50) TBXAS1HDAC11LMNATSHRNFKB1

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
US-20090264551-A1 Photocurable fixture for orthopedic surgery background of the invention ALCARE CO., LTD. 2009-10-22 US disclosed
EP-1910436-B1 ANHYDROUS DISPERSION OF POLYURETHANE(METH)ACRYLATE PARTICLES IN A REACTIVE DILUENT FACHHOCHSCHULE GELSENKIRCHEN (DE) 2009-01-28 EP disclosed
EP-1910436-A1 ANHYDROUS DISPERSION OF POLYURETHANE(METH)ACRYLATE PARTICLES IN A REACTIVE DILUENT Fachhochschule Gelsenkirchen (DE) 2008-04-16 EP disclosed
WO-2007012412-A1 ANHYDROUS DISPERSION OF POLYURETHANE(METH)ACRYLATE PARTICLES IN A REACTIVE DILUENT FACHHOCHSCHULE GELSENKIRCHEN (DE) 2007-02-01 WO disclosed
EP-0752427-B1 Polymerisation process for branched polymers ROEHM GMBH (DE) 1999-09-01 EP disclosed
US-5859140-A Method for the production of branched polymerizates ROEHM GMBH CHEMISCHE FABRIK (DE) 1999-01-12 US disclosed
EP-0752427-A2 Polymerisation process for branched polymers RÖHM GMBH (DE) 1997-01-08 EP disclosed