SCHEMBL17867180

SCHEMBL17867180

CC1CC(C)(C)[C@@H]2CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CCC(O)C(C)(C)[C@@H]5CC[C@]43C)[C@@]2(C)C1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 8/20 0.53
TOP2A P11388 2/20 0.46
CES2 O00748 1/20 0.46
CES1 P23141 1/20 0.46
GPBAR1 Q8TDU6 2/20 0.44
SLC10A1 Q14973 1/20 0.44
PTPRF P10586 1/20 0.44
ACP1 P24666 1/20 0.44
HSD11B1 P28845 1/20 0.43
HSD11B2 P80365 1/20 0.43
USP2 O75604 2/20 0.43
LMNA P02545 2/20 0.43
HIF1A Q16665 2/20 0.43
NT5E P21589 1/20 0.43
RELA Q04206 1/20 0.43
PRKCD Q05655 1/20 0.43
ALB P02768 1/20 0.42

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
SCHEMBL18760924 1.00 PTPN1 (0.53) PTPN1TOP2ACES2CES1GPBAR1
SCHEMBL17866956 0.83 GLI1 (0.36) PTPN1TOP2ACES2CES1GPBAR1
Tetrahymanol SCHEMBL5831685 0.81 PTPN1 (0.57) PTPN1TOP2ACES2CES1GPBAR1
Tetrahymanol SCHEMBL1401904 0.81 PTPN1 (0.57) PTPN1TOP2ACES2CES1GPBAR1
SCHEMBL18760925 0.73 PTPN1 (0.43) PTPN1
SCHEMBL16431162 0.73 PTPN1 (0.43) PTPN1
SCHEMBL18730228 0.73 PTPN1 (0.43) PTPN1TOP2ACES2CES1GPBAR1
SCHEMBL30901202 0.71 PTPN1 (0.53) PTPN1TOP2ACES2CES1GPBAR1
SCHEMBL17867237 0.71 SLC10A1 (0.55) PTPN1TOP2ACES2CES1GPBAR1
SCHEMBL12640552 0.71 PTPN1 (0.61) PTPN1TOP2ACES2CES1GPBAR1

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
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