SCHEMBL7024633

SCHEMBL7024633

Oc1c(-c2ccc(-c3ccccc3)cc2)cccc1-c1ncncn1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HNF4A P41235 1/20 0.43
HDAC4 P56524 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
BCL2L1 Q07817 2/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MMP3 P08254 1/20 0.38
USP7 Q93009 1/20 0.37
F2 P00734 4/20 0.36
F10 P00742 4/20 0.36
PLG P00747 4/20 0.36
PLAU P00749 4/20 0.36
PRSS1 P07477 4/20 0.36
PLAT P00750 3/20 0.36
F9 P00740 1/20 0.36
BACE1 P56817 2/20 0.36
CHRNB2 P17787 1/20 0.36

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
SCHEMBL27477978 0.83 ATM (0.41) BCL2L1ALDH1A1HPGDHSD17B10CHRNB2
SCHEMBL17313535 0.83 HDAC4 (0.39) HNF4AHDAC4HDAC2HDAC8HDAC6
Biphenyl SCHEMBL27881593 0.80 HPGD (0.54) BCL2L1ALDH1A1HPGDHSD17B10BACE1
SCHEMBL14965643 0.80 TNF (0.37) HNF4AHDAC4HDAC2HDAC8HDAC6
SCHEMBL30471775 0.79 ABCG2 (0.43) BCL2L1ALDH1A1HPGDHSD17B10CHRNB2
SCHEMBL8356292 0.79 ABCG2 (0.43) BCL2L1ALDH1A1HPGDHSD17B10CHRNB2
SCHEMBL28894327 0.77 ABCG2 (0.42) BCL2L1ALDH1A1HPGDHSD17B10CHRNB2
SCHEMBL60283 0.77 HDAC4 (0.65) HNF4AHDAC4HDAC2HDAC8HDAC6
SCHEMBL30605196 0.77 HDAC4 (0.65) HNF4AHDAC4HDAC2HDAC8HDAC6
SCHEMBL29177819 0.77 ATM (0.44) USP7ATMMAP4K4NCOA1NCOA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0899266-B1 Process for the production of benzoxazinones CIBA SC HOLDING AG (CH) 2003-01-15 EP disclosed
US-6040443-A Process for the production of benzoxazinones CIBA SPECIALTY CHEMICALS CORPORATION (US) 2000-03-21 US disclosed
EP-0899266-A1 Process for the production of benzoxazinones Ciba SC Holding AG (CH) 1999-03-03 EP disclosed