SCHEMBL14697607

SCHEMBL14697607

CNC(=O)CONC(=O)c1cc(Br)cc(Br)c1C(N)=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.36
HDAC3 O15379 1/20 0.33
HDAC4 P56524 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC7 Q8WUI4 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC10 Q969S8 1/20 0.33
HDAC11 Q96DB2 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
HDAC9 Q9UKV0 1/20 0.33
HDAC5 Q9UQL6 1/20 0.33
USP2 O75604 1/20 0.31
ALDH1A1 P00352 3/20 0.31
MAP2K1 Q02750 1/20 0.31
LMNA P02545 3/20 0.31
NPC1 O15118 2/20 0.31
RAB9A P51151 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
MAPK1 P28482 2/20 0.31

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
SCHEMBL14697608 0.84 HSD17B10 (0.35) HSD17B10HDAC3HDAC4HDAC1HDAC7
SCHEMBL14697610 0.75 POLB (0.36) ALDH1A1MAP2K1NPC1RAB9AKDM4E
SCHEMBL3751479 0.70 MEN1 (0.46) HSD17B10ALDH1A1LMNANPC1RAB9A
SCHEMBL14697606 0.68 HSD17B10 (0.39) HSD17B10HTTAKR1C4AKR1C3AKR1C2
SCHEMBL1003689 0.67 TSHR (0.43) HSD17B10ALDH1A1MAP2K1LMNAMAPK1
SCHEMBL14697611 0.64 KDM4E (0.38) HSD17B10ALDH1A1MAP2K1KDM4EHPGD
SCHEMBL27953419 0.62 CREBBP (0.41) HSD17B10HDAC2HDAC8HDAC6USP2
SCHEMBL2722031 0.62 HSD17B10 (0.65) HSD17B10ALDH1A1LMNASMN1; SMN2KDM4E
SCHEMBL3347499 0.61 PKM (0.44) ALDH1A1LMNANPC1RAB9ASMN1; SMN2
SCHEMBL8889502 0.61 CA12 (0.34) HSD17B10ALDH1A1LMNANPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2744784-A1 CARBAMOYLMETHOXY- AND CARBAMOYLMETHYLTHIO- AND CARBAMOYLMETHYLAMINO BENZAMIDES FOR COMBATING INVERTEBRATE PESTS BASF SE (DE) 2014-06-25 EP disclosed
WO-2013024170-A1 CARBAMOYLMETHOXY- AND CARBAMOYLMETHYLTHIO- AND CARBAMOYLMETHYLAMINO BENZAMIDES FOR COMBATING INVERTEBRATE PESTS BASF SE (DE) 2013-02-21 WO disclosed