SCHEMBL4357790

SCHEMBL4357790

CC(C)C(C)(C)c1cnccn1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.38
KDM4E B2RXH2 3/20 0.36
SMN1; SMN2 Q16637 3/20 0.35
ALDH1A1 P00352 2/20 0.35
HSP90AA1 P07900 1/20 0.34
LMNA P02545 1/20 0.34
LONP1 P36776 2/20 0.31
MAPK1 P28482 1/20 0.30
NAPRT Q6XQN6 1/20 0.30
HCAR2 Q8TDS4 1/20 0.30
NPC1 O15118 1/20 0.30
TP53 P04637 1/20 0.30
MAPT P10636 1/20 0.30
NFKB1 P19838 1/20 0.30
RAB9A P51151 1/20 0.30
NFKB2 Q00653 1/20 0.30
RELA Q04206 1/20 0.30

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
SCHEMBL22863246 0.83 CYP19A1 (0.38) CYP19A1KDM4ESMN1; SMN2ALDH1A1HSP90AA1
SCHEMBL11125408 0.79 CYP19A1 (0.36) CYP19A1KDM4ESMN1; SMN2ALDH1A1HSP90AA1
SCHEMBL26833406 0.79 CYP19A1 (0.43) CYP19A1KDM4ESMN1; SMN2ALDH1A1HSP90AA1
SCHEMBL781412 0.79 CYP19A1 (0.43) CYP19A1KDM4ESMN1; SMN2ALDH1A1HSP90AA1
SCHEMBL781413 0.79 CYP19A1 (0.43) CYP19A1KDM4ESMN1; SMN2ALDH1A1HSP90AA1
SCHEMBL179284 0.77 CYP19A1 (0.42) CYP19A1KDM4ESMN1; SMN2ALDH1A1HSP90AA1
SCHEMBL31256061 0.77 CYP19A1 (0.42) CYP19A1KDM4ESMN1; SMN2ALDH1A1HSP90AA1
SCHEMBL20774860 0.73 CYP19A1 (0.40) CYP19A1KDM4ESMN1; SMN2HSP90AA1LMNA
SCHEMBL20128883 0.73 CYP19A1 (0.40) CYP19A1KDM4ESMN1; SMN2HSP90AA1NAPRT
SCHEMBL8289716 0.73 CYP19A1 (0.40) CYP19A1KDM4ESMN1; SMN2HSP90AA1NAPRT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103497163-A Synthesis method of dimethyl isobutyl pyrazine PUCHENG YONGFANG FRAGRANCE TECHNOLOGY CO LTD 2014-01-08 CN claimed
US-11421223-B2 Processes and host cells for genome, pathway, and biomolecular engineering ENEVOLV, INC. (US) 2022-08-23 US disclosed
US-20190309289-A1 PROCESSES AND HOST CELLS FOR GENOME, PATHWAY, AND BIOMOLECULAR ENGINEERING ENEVOLV, INC. 2019-10-10 US disclosed
US-10370654-B2 Processes and host cells for genome, pathway, and biomolecular engineering ENEVOLV, INC. (US) 2019-08-06 US disclosed
US-20180320170-A1 PROCESSES AND HOST CELLS FOR GENOME, PATHWAY, AND BIOMOLECULAR ENGINEERING ENEVOLV, INC. 2018-11-08 US disclosed
US-9944925-B2 Processes and host cells for genome, pathway, and biomolecular engineering ENEVOLV, INC. 2018-04-17 US disclosed
US-20160186168-A1 PROCESSES AND HOST CELLS FOR GENOME, PATHWAY, AND BIOMOLECULAR ENGINEERING ENEVOLV, INC. 2016-06-30 US disclosed
CN-103497163-A Synthesis method of dimethyl isobutyl pyrazine PUCHENG YONGFANG FRAGRANCE TECHNOLOGY CO LTD 2014-01-08 CN disclosed
US-20090032592-A1 SPHERICAL ENCODED BEADS NOVO NORDISK A/S (DK) 2009-02-05 US disclosed
US-6579553-B1 Reaction product cysteine, hydrogen sulfide, ammonium sulfide and extracellular liquid fusarium extracts used as food flavors ZENECA LIMITED (GB) 2003-06-17 US disclosed