SCHEMBL8390695

SCHEMBL8390695

CCCCCCC(=O)c1ccc(S(=O)(=O)Nc2ccc(O)cc2)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B3 P37058 8/20 0.67
MAPT P10636 1/20 0.52
LMNA P02545 1/20 0.51
POLB P06746 1/20 0.51
GAA P10253 1/20 0.51
GFER P55789 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
GHSR Q92847 1/20 0.51
THRA P10827 1/20 0.50
UQCRB P14927 1/20 0.50
STS P08842 4/20 0.49
HDAC3 O15379 1/20 0.49
HDAC4 P56524 1/20 0.49
HDAC1 Q13547 1/20 0.49
HDAC7 Q8WUI4 1/20 0.49
HDAC2 Q92769 1/20 0.49
HDAC10 Q969S8 1/20 0.49
HDAC11 Q96DB2 1/20 0.49
HDAC8 Q9BY41 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49

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
SCHEMBL8389677 1.00 HSD17B3 (0.67) HSD17B3MAPTLMNAPOLBGAA
SCHEMBL8756459 1.00 HSD17B3 (0.67) HSD17B3MAPTLMNAPOLBGAA
SCHEMBL8388373 0.93 HSD17B3 (0.58) HSD17B3MAPTLMNAPOLBGAA
SCHEMBL8391469 0.85 PSMB11 (0.64) MAPTLMNAPOLBGAAGFER
SCHEMBL8756851 0.85 PSMB11 (0.64) MAPTLMNAPOLBGAAGFER
SCHEMBL8756817 0.82 RXFP1 (0.65) MAPTGHSRUQCRBADRB3
SCHEMBL1464079 0.82 HSD17B3 (1.00) HSD17B3MAPTPOLBGAASTS
SCHEMBL2720252 0.82 HSD17B3 (1.00) HSD17B3MAPTPOLBGAASTS
SCHEMBL11567883 0.82 HSD17B3 (1.00) HSD17B3MAPTPOLBGAASTS
SCHEMBL28560063 0.82 HSD17B3 (1.00) HSD17B3MAPTPOLBGAASTS

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
US-6004899-A SURFACE TREATED WITH SILANE, TITANATE, AND/OR ALUMINUM COUPLING AGENT; PIGMENT; ERASIBILITY MITSUBISHI PAPER MILLS LIMITED (JP) 1999-12-21 US disclosed
EP-0574879-B1 Reversible heat-sensitive recording material MITSUBISHI PAPER MILLS LTD (JP) 1997-05-02 EP disclosed
US-5395815-A Phenolic compound electron acceptor; images; contrast; stability MITSUBISHI PAPER MILLS LIMITED (JP) 1995-03-07 US disclosed
EP-0574879-A1 Reversible heat-sensitive recording material MITSUBISHI PAPER MILLS, LTD. (JP) 1993-12-22 EP disclosed