SCHEMBL16433264

SCHEMBL16433264

CC1C[C@]2(C)[C@H]3CC[C@@H]4[C@@]5(C)CCCC(C)(C)[C@@H]5CC[C@@]4(C)[C@]3(C)CC[C@H]2C(C)(C)C1O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 5/20 0.49
IDO1 P14902 2/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
TSHR P16473 1/20 0.39
CYP2C19 P33261 1/20 0.39
PTPN2 P17706 1/20 0.38
CYP19A1 P11511 1/20 0.38
HIF1A Q16665 2/20 0.37
EPAS1 Q99814 1/20 0.37
NR1H4 Q96RI1 1/20 0.36
GLI1 P08151 1/20 0.36
RELA Q04206 1/20 0.36
PLA2G2A P14555 1/20 0.35
ENTPD5 O75356 1/20 0.34
RPS6KA5 O75582 1/20 0.34
MAPKAPK2 P49137 1/20 0.34
PTPRF P10586 1/20 0.34
ACP1 P24666 1/20 0.34

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
SCHEMBL17866956 0.84 GLI1 (0.36) PTPN1PTPN2GLI1RELAPTPRF
SCHEMBL29501291 0.80 PTPN1 (0.68) PTPN1IDO1ALDH1A1CYP3A4CYP2C9
Tetrahymanol SCHEMBL1401904 0.80 PTPN1 (0.57) PTPN1HIF1ARELAPTPRFACP1
Tetrahymanol SCHEMBL5831685 0.80 PTPN1 (0.57) PTPN1HIF1ARELAPTPRFACP1
SCHEMBL19185380 0.75 PTPN1 (0.62) PTPN1IDO1ALDH1A1CYP3A4CYP2C9
SCHEMBL17867180 0.70 PTPN1 (0.53) PTPN1HIF1ARELAPTPRFACP1
SCHEMBL18760924 0.70 PTPN1 (0.53) PTPN1HIF1ARELAPTPRFACP1
SCHEMBL29501288 0.70 PTPN1 (0.63) PTPN1IDO1ALDH1A1CYP3A4CYP2C9
SCHEMBL30812410 0.69 PTPN1 (0.48) PTPN1IDO1ALDH1A1CYP3A4CYP2C9
SCHEMBL17867295 0.67 PTPN1 (0.74) PTPN1IDO1ALDH1A1CYP3A4CYP2C9

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 7 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
EP-3027754-A1 PROCESSES AND HOST CELLS FOR GENOME, PATHWAY, AND BIOMOLECULAR ENGINEERING enEvolv, Inc. (US) 2016-06-08 EP disclosed
WO-2015017866-A1 PROCESSES AND HOST CELLS FOR GENOME, PATHWAY, AND BIOMOLECULAR ENGINEERING ENEVOLV, INC. (US) 2015-02-05 WO disclosed