SCHEMBL9586704

SCHEMBL9586704

CCOC(=O)c1nocc1-c1ccc(F)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.49
PRKCZ Q05513 1/20 0.49
ALDH1A1 P00352 4/20 0.48
KDM4E B2RXH2 3/20 0.48
HPGD P15428 2/20 0.48
GAA P10253 2/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
GABRA2 P47869 2/20 0.48
GABRB2 P47870 2/20 0.48
MAPK14 Q16539 2/20 0.47
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
TRPM8 Q7Z2W7 1/20 0.46
MAPT P10636 3/20 0.45
PKM P14618 1/20 0.45
MAPK1 P28482 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
GCGR P47871 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL9585857 0.86 TARBP2 (0.56) LMNAPRKCZALDH1A1KDM4EHPGD
SCHEMBL22230646 0.86 TARBP2 (0.56) KDM4EMEN1KMT2AGABRA2GABRB2
SCHEMBL892693 0.86 TARBP2 (0.52) LMNAALDH1A1KDM4EHPGDGAA
SCHEMBL9587202 0.84 TRPM8 (0.50) LMNAALDH1A1KDM4EHPGDGAA
SCHEMBL4060790 0.78 ELANE (0.46) LMNAALDH1A1KDM4EHPGDMEN1
SCHEMBL1776614 0.78 KDM4E (0.51) LMNAPRKCZALDH1A1KDM4EHPGD
SCHEMBL27809428 0.77 MAPK14 (0.49) KMT2AMAPK14GCGRPTGS2
Phenylacetylene SCHEMBL1704028 0.77 TARBP2 (0.44) LMNAALDH1A1KDM4EHPGDGAA
SCHEMBL9586903 0.76 L3MBTL1 (0.50) ALDH1A1GABRA2GABRB2TRPM8MAPT
SCHEMBL27646217 0.76 PTGS2 (0.49) MAPK14MAPK1PTGS2

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
US-5204482-A Ethylenediamine monoamide heteroaryl derivatives HOFFMAN-LAROCHE INC. (US) 1993-04-20 US disclosed
US-5011849-A Monoamine oxidase inhibitors HOFFMANN-LA ROCHE INC. (US) 1991-04-30 US disclosed