SCHEMBL6422267

SCHEMBL6422267

CC1(C)CCCC2(C)C(=CO)C(=O)CCC12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 2/20 0.48
▸ PTPN2 P17706 2/20 0.40
▸ PTPN1 P18031 2/20 0.40
▸ USP2 O75604 2/20 0.39
▸ TP53 P04637 2/20 0.39
▸ CYP3A4 P08684 2/20 0.39
▸ HSP90AA1 P07900 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ PIK3CA P42336 5/20 0.39
▸ PIK3CG P48736 5/20 0.39
▸ ALOX5 P09917 1/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ ALOX12 P18054 1/20 0.39
▸ CETP P11597 2/20 0.37
▸ TSHR P16473 1/20 0.36
▸ PNLIP P16233 2/20 0.36

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
SCHEMBL25435184 1.00 CYP19A1 (0.48) CYP19A1PTPN2PTPN1USP2TP53
SCHEMBL25436089 1.00 CYP19A1 (0.48) CYP19A1PTPN2PTPN1USP2TP53
SCHEMBL30585230 1.00 CYP19A1 (0.48) CYP19A1PTPN2PTPN1USP2TP53
SCHEMBL25432736 1.00 CYP19A1 (0.48) CYP19A1PTPN2PTPN1USP2TP53
SCHEMBL21917264 0.74 CYP19A1 (0.49) CYP19A1USP2TP53CYP3A4HSP90AA1
SCHEMBL14880005 0.74 CYP19A1 (0.49) CYP19A1USP2TP53CYP3A4HSP90AA1
SCHEMBL3146912 0.69 CYP19A1 (0.44) CYP19A1USP2TP53CYP3A4HSP90AA1
SCHEMBL266913 0.69 CYP19A1 (0.44) CYP19A1USP2TP53CYP3A4HSP90AA1
SCHEMBL16010818 0.67 USP2 (0.43) CYP19A1PTPN2PTPN1USP2TP53
SCHEMBL14879851 0.67 USP2 (0.43) CYP19A1PTPN2PTPN1USP2TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1509181-A1 PERSONAL CARE ARTICLE AND METHOD FOR INHIBITING ATTACHMENT OF YEAST TO SKIN Kimberly-Clark Worldwide, Inc. (US) 2005-03-02 — — EP disclosed
WO-2004112819-A1 COMPOSITIONS AND METHODS OF TREATMENT COMPRISING PLANT EXTRACTS GELSTAT CORPORATION (US) 2004-12-29 — — WO disclosed
WO-2003101356-A1 PERSONAL CARE ARTICLE AND METHOD FOR INHIBITING ATTACHMENT OF YEAST TO SKIN KIMBERLY-CLARK WORLDWIDE, INC. (US) 2003-12-11 — — WO disclosed
US-20030224034-A1 Personal care article and method for inhibiting attachment of yeast to skin KIMBERLY-CLARK WORLDWIDE, INC. 2003-12-04 — — US disclosed
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