SCHEMBL9038798

SCHEMBL9038798

C=C(C)C(=O)OC(C)O.C=CN1CCCC1=O

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.33
ATM Q13315 1/20 0.33
LMNA P02545 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA3 P07451 1/20 0.33
CA4 P22748 1/20 0.33
CA6 P23280 1/20 0.33
CA5A P35218 1/20 0.33
CA7 P43166 1/20 0.33
CA9 Q16790 1/20 0.33
CA13 Q8N1Q1 1/20 0.33
CA14 Q9ULX7 1/20 0.33
CA5B Q9Y2D0 1/20 0.33
PIK3CD O00329 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
SCHEMBL3804910 0.86 KMT2A (0.31) KMT2AATMLMNACA12CA1
SCHEMBL362768 0.86 KMT2A (0.31) KMT2AATMLMNACA12CA1
SCHEMBL23854193 0.84 LMNA (0.33) LMNACA12CA1CA2CA3
SCHEMBL4385907 0.84 LMNA (0.34) KMT2AATMLMNACA12CA1
SCHEMBL264350 0.83 ALDH1A1 (0.46) KMT2AATMLMNA
SCHEMBL7036737 0.83 LMNA (0.34) LMNACA12CA1CA2CA3
SCHEMBL28346618 0.82 KMT2A (0.35) KMT2AATMLMNA
Isopropyl Alcohol SCHEMBL28478837 0.81 PIK3CD (0.40) KMT2ALMNACA12CA1CA2
SCHEMBL28333248 0.81 THRB (0.41) KMT2AATMLMNACA12CA1
SCHEMBL29168447 0.80 LMNA (0.36) LMNACA12CA1CA2CA3

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
US-5326506-A Cores and polymerization, machining and forming composites AMERICAN CYANAMID COMPANY (US) 1994-07-05 US claimed
US-20130060143-A1 DOPPLER PROBE PLACEMENT DEVICE AND METHOD OF USE VASAMED, INC. (US) 2013-03-07 US disclosed
CN-1186330-C Polymerizable hydrophilio ultraviolet light absorbing manomers PHARMACIA & UPJOHN BV (NL) 2005-01-26 CN disclosed
CN-1300283-A Polymerizable hydrophilio ultraviolet light absorbing manomers PHARMACIA & UPJOHN BV (NL) 2001-06-20 CN disclosed
EP-0554409-B1 OLIGO(2-ALKENYL AZLACTONES) MINNESOTA MINING & MFG (US) 1996-03-13 EP disclosed
WO-1992007012-A1 OLIGO(2-ALKENYL AZLACTONES) MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1992-04-30 WO disclosed
US-5091489-A Using acid catalyst MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1992-02-25 US disclosed
US-5081197-A Oligo(2-alkenyl azlactones) MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1992-01-14 US disclosed
US-4668506-A Sustained-release formulation containing and amino acid polymer BAUSCH & LOMB INCORPORATED (US) 1987-05-26 US disclosed
EP-0219208-A2 Substained-release formulation containing an amino acid polymer BAUSCH & LOMB INCORPORATED (US) 1987-04-22 EP disclosed