SCHEMBL8624035

SCHEMBL8624035

CCNC(=O)C(=NOCC)c1ccccc1COc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 7/20 0.48
CAPN1 P07384 1/20 0.41
TSHR P16473 1/20 0.39
MAPK10 P53779 1/20 0.39
HDAC3 O15379 1/20 0.38
HDAC4 P56524 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC7 Q8WUI4 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC10 Q969S8 1/20 0.38
HDAC11 Q96DB2 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
HDAC9 Q9UKV0 1/20 0.38
HDAC5 Q9UQL6 1/20 0.38
PPARG P37231 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
NR4A2 P43354 1/20 0.38

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
SCHEMBL8624032 1.00 HIF1A (0.48) HIF1ACAPN1TSHRMAPK10HDAC3
SCHEMBL8400528 0.89 HIF1A (0.49) HIF1ACAPN1TSHRMAPK10PPARG
SCHEMBL8621337 0.89 HIF1A (0.60) HIF1ACAPN1TSHRMAPK10HDAC3
SCHEMBL8400532 0.89 HIF1A (0.49) HIF1ACAPN1TSHRMAPK10PPARG
SCHEMBL8621332 0.89 HIF1A (0.60) HIF1ACAPN1TSHRMAPK10HDAC3
SCHEMBL8618332 0.86 HIF1A (0.50) HIF1ACAPN1TSHRMAPK10SMN1; SMN2
SCHEMBL8618330 0.86 HIF1A (0.50) HIF1ACAPN1TSHRMAPK10SMN1; SMN2
SCHEMBL8396138 0.86 HIF1A (0.54) HIF1AKDM4E
SCHEMBL8396132 0.86 HIF1A (0.54) HIF1AKDM4E
SCHEMBL8395441 0.85 PTGDR2 (0.41) HIF1ATP53HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0658541-B1 PROCESS FOR PRODUCING CARBOXYLIC ACID DERIVATIVE SHIONOGI & CO (JP) 1998-05-20 EP disclosed
US-5510506-A Process for producing carboxylic acid derivatives SHIONOGI & CO., LTD. (JP) 1996-04-23 US disclosed
US-5498792-A Process of producing N-alkylacetamides SHIONOGI & CO., LTD. (JP) 1996-03-12 US disclosed
EP-0658541-A1 PROCESS FOR PRODUCING CARBOXYLIC ACID DERIVATIVE SHIONOGI & CO., LTD. (JP) 1995-06-21 EP disclosed
EP-0644183-A2 Process of producing N-alkylacetamides SHIONOGI & CO., LTD. (JP) 1995-03-22 EP disclosed