SCHEMBL16670594

SCHEMBL16670594

O=Cc1ccc(C(=O)NO)o1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 8/20 0.62
HDAC1 Q13547 8/20 0.62
ALDH1A1 P00352 4/20 0.47
TSHR P16473 1/20 0.47
CSF1R P07333 1/20 0.47
HDAC3 O15379 2/20 0.40
HDAC6 Q9UBN7 2/20 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
HDAC9 Q9UKV0 1/20 0.40
HDAC5 Q9UQL6 1/20 0.40
KDM4E B2RXH2 3/20 0.40
TDP1 Q9NUW8 1/20 0.40
GAA P10253 1/20 0.38
POLB P06746 2/20 0.38
LMNA P02545 1/20 0.38
NPC1 O15118 1/20 0.37

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
SCHEMBL13627713 0.82 CSF1R (0.46) HDAC4HDAC1ALDH1A1TSHRCSF1R
SCHEMBL28879753 0.80 HDAC1 (0.55) HDAC4HDAC1ALDH1A1TSHRHDAC3
Methane SCHEMBL16742564 0.78 ALDH1A1 (0.44) HDAC4HDAC1ALDH1A1TSHRCSF1R
SCHEMBL17495564 0.77 KDM4E (0.52) HDAC4HDAC1ALDH1A1TSHRCSF1R
SCHEMBL86396 0.77 KDM4E (0.52) HDAC4HDAC1ALDH1A1TSHRCSF1R
SCHEMBL13402898 0.77 ALDH1A1 (0.49) HDAC4HDAC1ALDH1A1TSHRCSF1R
SCHEMBL7492014 0.77 RAB9A (0.55) HDAC4HDAC1ALDH1A1TSHRCSF1R
SCHEMBL13402907 0.77 POLB (0.61) HDAC4HDAC1ALDH1A1TSHRCSF1R
SCHEMBL22289272 0.75 HPGD (0.49) ALDH1A1TSHRCSF1RKDM4EPOLB
SCHEMBL13402910 0.75 POLB (0.44) HDAC4HDAC1ALDH1A1TSHRCSF1R

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-9982094-B2 Compounds and methods for producing nylon 6 EMPIRE TECHNOLOGY DEVELOPMENT LLC (US) 2018-05-29 US disclosed
US-20160304669-A1 COMPOUNDS AND METHODS FOR PRODUCING NYLON 6 EMPIRE TECHNOLOGY DEVELOPMENT LLC (US) 2016-10-20 US disclosed
EP-3060597-A1 COMPOUNDS AND METHODS FOR PRODUCING NYLON 6 Empire Technology Development LLC (US) 2016-08-31 EP disclosed
WO-2015060829-A1 COMPOUNDS AND METHODS FOR PRODUCING NYLON 6 EMPIRE TECHNOLOGY DEVELOPMENT LLC (US) 2015-04-30 WO disclosed