SCHEMBL7774673

SCHEMBL7774673

C=CCNC(CC)C(=O)OC

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
ALDH1A1 P00352 2/20 0.35
NPSR1 Q6W5P4 1/20 0.35
TAS1R3 Q7RTX0 1/20 0.34
TAS1R1 Q7RTX1 1/20 0.34
FAAH O00519 1/20 0.33
PKM P14618 1/20 0.33
BIRC2 Q13490 1/20 0.33

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
SCHEMBL7772608 0.87 ALDH1A1 (0.43) KMT2AALDH1A1NPSR1FAAH
SCHEMBL27877361 0.83 MEN1 (0.34) MEN1KMT2AALDH1A1NPSR1TAS1R3
SCHEMBL12824095 0.81 TAS1R3 (0.48) CA1CA2TAS1R3TAS1R1BIRC2
SCHEMBL29197932 0.81 ALDH1A1 (0.37) CA1CA2MEN1KMT2AALDH1A1
Hydrochloric Acid SCHEMBL18951940 0.81 MEN1 (0.33) MEN1KMT2AALDH1A1NPSR1TAS1R3
SCHEMBL29197934 0.81 ALDH1A1 (0.37) CA1CA2MEN1KMT2AALDH1A1
SCHEMBL7774746 0.81 TSHR (0.47) CA1CA2ALDH1A1NPSR1FAAH
SCHEMBL614517 0.80 ALDH1A1 (0.36) KMT2AALDH1A1FAAH
SCHEMBL28788295 0.79 CA1 (0.35) CA1CA2TAS1R3TAS1R1BIRC2
SCHEMBL28788292 0.79 CA1 (0.35) CA1CA2TAS1R3TAS1R1BIRC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0711813-B1 Antifouling coating composition HITACHI CHEMICAL CO LTD (JP) 2001-07-25 EP disclosed
US-5773508-A BIODEGRADABLE POLYMER OF ADDITION COPOLYMERS FOR PROTECTIVE COATINGS HITACHI CHEMICAL COMPANY, LTD. (JP) 1998-06-30 US disclosed
EP-0711813-A2 Coating varnish composition and antifouling coating composition Hitachi Chemical Co., Ltd. (JP) 1996-05-15 EP disclosed