SCHEMBL1248348

SCHEMBL1248348

OCCNCCCNCCCCNCCCNCCO

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 3/20 0.47
CYP1A2 P05177 3/20 0.47
CA12 O43570 4/20 0.44
CA2 P00918 4/20 0.44
CA4 P22748 4/20 0.44
CA6 P23280 4/20 0.44
CA5A P35218 4/20 0.44
CA7 P43166 4/20 0.44
CA9 Q16790 4/20 0.44
CA14 Q9ULX7 4/20 0.44
CA5B Q9Y2D0 4/20 0.44
CA3 P07451 3/20 0.44
ALDH1A1 P00352 4/20 0.42
ALOX15 P16050 3/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
TSHR P16473 2/20 0.42
F13A1 P00488 2/20 0.42
THPO P40225 2/20 0.42
HSD17B10 Q99714 2/20 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
SCHEMBL8109893 0.96 ALDH1A1 (0.44) CYP2C19CYP1A2CA12CA2CA4
SCHEMBL2032344 0.96 CA12 (0.47) CYP2C19CYP1A2CA12CA2CA4
SCHEMBL1001821 0.93 ALOX15 (0.47) CYP2C19CYP1A2CA12CA2CA4
SCHEMBL9812850 0.93 ALOX15 (0.47) CYP2C19CYP1A2CA12CA2CA4
Bromide SCHEMBL30669878 0.93 CA12 (0.44) CYP2C19CYP1A2CA12CA2CA4
SCHEMBL10961785 0.93 ALOX15 (0.47) CYP2C19CYP1A2CA12CA2CA4
SCHEMBL3967822 0.90
Diethanolamine SCHEMBL2256873 0.89
SCHEMBL8453720 0.87 TP53 (0.44) CA12CA2CA9ALDH1A1ALOX15
SCHEMBL9801759 0.87 TP53 (0.44) CA12CA2CA9ALDH1A1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11583608-B2 Wound dressings, methods of using the same and methods of forming the same NOVAN, INC. (US) 2023-02-21 US claimed
US-20180214598-A1 WOUND DRESSINGS, METHODS OF USING THE SAME AND METHODS OF FORMING THE SAME LIGAND PHARMACEUTICALS INCORPORATED 2018-08-02 US claimed
US-9919072-B2 Wound dressings, methods of using the same and methods of forming the same NOVAN, INC. (US) 2018-03-20 US claimed
EP-2467173-A2 WOUND DRESSINGS, METHODS OF USING THE SAME AND METHODS OF FORMING THE SAME Novan, Inc. (US) 2012-06-27 EP claimed
US-20120136323-A1 Wound Dressings, Methods of Using the Same and Methods of Forming the Same LIGAND PHARMACEUTICALS INCORPORATED 2012-05-31 US claimed
WO-2011022680-A2 WOUND DRESSINGS, METHODS OF USING THE SAME AND METHODS OF FORMING THE SAME NOVAN, INC. (US) 2011-02-24 WO claimed
US-6506811-B2 Carbamate solutions BASF AKTIENGESELLSCHAFT (DE) 2003-01-14 US claimed
US-11583608-B2 Wound dressings, methods of using the same and methods of forming the same NOVAN, INC. (US) 2023-02-21 US disclosed
EP-2467173-B1 WOUND DRESSINGS, METHODS OF USING THE SAME AND METHODS OF FORMING THE SAME NOVAN INC (US) 2019-04-24 EP disclosed
US-20180214598-A1 WOUND DRESSINGS, METHODS OF USING THE SAME AND METHODS OF FORMING THE SAME LIGAND PHARMACEUTICALS INCORPORATED 2018-08-02 US disclosed
US-9919072-B2 Wound dressings, methods of using the same and methods of forming the same NOVAN, INC. (US) 2018-03-20 US disclosed
EP-2467173-A2 WOUND DRESSINGS, METHODS OF USING THE SAME AND METHODS OF FORMING THE SAME Novan, Inc. (US) 2012-06-27 EP disclosed
US-20120136323-A1 Wound Dressings, Methods of Using the Same and Methods of Forming the Same LIGAND PHARMACEUTICALS INCORPORATED 2012-05-31 US disclosed
WO-2011022680-A2 WOUND DRESSINGS, METHODS OF USING THE SAME AND METHODS OF FORMING THE SAME NOVAN, INC. (US) 2011-02-24 WO disclosed
EP-1000955-B1 Carbamate solutions BASF AG (DE) 2005-04-27 EP disclosed
US-6506811-B2 Carbamate solutions BASF AKTIENGESELLSCHAFT (DE) 2003-01-14 US disclosed
US-20020133040-A1 Carbamate solutions BASF AKTIENGESELLSCHAFT 2002-09-19 US disclosed
US-6316662-B1 BLOWING AGENTS FOR POLYURETHANE FOAMS BASF AKTIENGESELLSCHAFT (DE) 2001-11-13 US disclosed
EP-1000955-A1 Carbamate solutions BASF AKTIENGESELLSCHAFT (DE) 2000-05-17 EP disclosed